
Organic acids and derivatives























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1,3-Dihydro-1-(1,2,3,6-tetrahydro-4-pyridinyl)-2H-benzimidazole-2-one, 97%, Thermo Scientific Chemicals
CAS: 2147-83-3 Molecular Formula: C12H14N3O Molecular Weight (g/mol): 216.26 MDL Number: MFCD00044827 InChI Key: YFEOSTXFQCDCAR-UHFFFAOYSA-O Synonym: 1,3-dihydro-1-1,2,3,6-tetrahydro-4-pyridinyl-2h-benzimidazole-2-one,1,3-dihydro-1-1,2,3,6-tetrahydro-4-pyridinyl-2h-benzimidazol-2-one,3-1,2,3,6-tetrahydropyridin-4-yl-1h-benzimidazol-2-one,1-1,2,3,6-tetrahydro-4-pyridyl-2-benzimidazolinone,1-1,2,3,6-tetrahydropyridin-4-yl-1,3-dihydro-2h-benzimidazol-2-one,1-1,2,3,6-tetrahydropyridin-4-yl-2,3-dihydro-1h-1,3-benzodiazol-2-one,1-4-1,2,5,6-tetrahydropyridyl-3-hydrobenzimidazol-2-one,1-1,2,3,6-tetrahydropyridin-4-yl-3h-1,3-benzodiazol-2-one,benzoimidazol-2-one,1-1,2,3,6-tetrahydro-pyridin-4-yl-1,3-dihydro PubChem CID: 75070 IUPAC Name: 3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-benzimidazol-2-one SMILES: O=C1NC2=CC=CC=C2N1C1=CC[NH2+]CC1

PubChem CID | 75070 |
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CAS | 2147-83-3 |
Molecular Weight (g/mol) | 216.26 |
MDL Number | MFCD00044827 |
SMILES | O=C1NC2=CC=CC=C2N1C1=CC[NH2+]CC1 |
Synonym | 1,3-dihydro-1-1,2,3,6-tetrahydro-4-pyridinyl-2h-benzimidazole-2-one,1,3-dihydro-1-1,2,3,6-tetrahydro-4-pyridinyl-2h-benzimidazol-2-one,3-1,2,3,6-tetrahydropyridin-4-yl-1h-benzimidazol-2-one,1-1,2,3,6-tetrahydro-4-pyridyl-2-benzimidazolinone,1-1,2,3,6-tetrahydropyridin-4-yl-1,3-dihydro-2h-benzimidazol-2-one,1-1,2,3,6-tetrahydropyridin-4-yl-2,3-dihydro-1h-1,3-benzodiazol-2-one,1-4-1,2,5,6-tetrahydropyridyl-3-hydrobenzimidazol-2-one,1-1,2,3,6-tetrahydropyridin-4-yl-3h-1,3-benzodiazol-2-one,benzoimidazol-2-one,1-1,2,3,6-tetrahydro-pyridin-4-yl-1,3-dihydro |
IUPAC Name | 3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-benzimidazol-2-one |
InChI Key | YFEOSTXFQCDCAR-UHFFFAOYSA-O |
Molecular Formula | C12H14N3O |
Triethyl phosphonoacetate, 97%
CAS: 867-13-0 Molecular Formula: C8H17O5P Molecular Weight (g/mol): 224.19 InChI Key: GGUBFICZYGKNTD-UHFFFAOYSA-N Synonym: triethyl phosphonoacetate,ethyl 2-diethoxyphosphoryl acetate,ethyl diethoxyphosphoryl acetate,ethyl diethylphosphono acetate,triethyl phosphonoethanoate,diethyl carboethoxymethylphosphonate,diethyl ethoxycarbonylmethanephosphonate,diethylphosphonoacetic acid ethyl ester,diethyl carbethoxymethylphosphonate PubChem CID: 13345 IUPAC Name: ethyl 2-diethoxyphosphorylacetate SMILES: CCOC(=O)CP(=O)(OCC)OCC

PubChem CID | 13345 |
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CAS | 867-13-0 |
Molecular Weight (g/mol) | 224.19 |
SMILES | CCOC(=O)CP(=O)(OCC)OCC |
Synonym | triethyl phosphonoacetate,ethyl 2-diethoxyphosphoryl acetate,ethyl diethoxyphosphoryl acetate,ethyl diethylphosphono acetate,triethyl phosphonoethanoate,diethyl carboethoxymethylphosphonate,diethyl ethoxycarbonylmethanephosphonate,diethylphosphonoacetic acid ethyl ester,diethyl carbethoxymethylphosphonate |
IUPAC Name | ethyl 2-diethoxyphosphorylacetate |
InChI Key | GGUBFICZYGKNTD-UHFFFAOYSA-N |
Molecular Formula | C8H17O5P |
N-(2-Hydroxyethyl)phthalimide, 99%
CAS: 3891-07-4 Molecular Formula: C10H9NO3 Molecular Weight (g/mol): 191.19 MDL Number: MFCD00005903 InChI Key: MWFLUYFYHANMCM-UHFFFAOYSA-N Synonym: 2-1,2,2-trimethylpropylcarbamoyl benzoic acid,2-3,3-dimethylbutan-2-yl carbamoyl benzoic acid,2-1,2,2-trimethylpropyl amino carbonyl benzoic acid,n-pinacolylphthalamic acid,2-3,3-dimethylbutan-2-ylcarbamoyl benzoic acid,+-n-pinacolylphthalamic acid PubChem CID: 3354762 IUPAC Name: 2-(3,3-dimethylbutan-2-ylcarbamoyl)benzoic acid SMILES: OCCN1C(=O)C2=CC=CC=C2C1=O

PubChem CID | 3354762 |
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CAS | 3891-07-4 |
Molecular Weight (g/mol) | 191.19 |
MDL Number | MFCD00005903 |
SMILES | OCCN1C(=O)C2=CC=CC=C2C1=O |
Synonym | 2-1,2,2-trimethylpropylcarbamoyl benzoic acid,2-3,3-dimethylbutan-2-yl carbamoyl benzoic acid,2-1,2,2-trimethylpropyl amino carbonyl benzoic acid,n-pinacolylphthalamic acid,2-3,3-dimethylbutan-2-ylcarbamoyl benzoic acid,+-n-pinacolylphthalamic acid |
IUPAC Name | 2-(3,3-dimethylbutan-2-ylcarbamoyl)benzoic acid |
InChI Key | MWFLUYFYHANMCM-UHFFFAOYSA-N |
Molecular Formula | C10H9NO3 |
Diethyl (2-oxopropyl)phosphonate, 96%
CAS: 1067-71-6 Molecular Formula: C7H19O4P Molecular Weight (g/mol): 198.2 MDL Number: MFCD00044728 InChI Key: RSAFKRSMGOSHRK-UHFFFAOYSA-N Synonym: diethyl 2-oxopropyl phosphonate,diethyl acetonylphosphonate,diethyl 2-oxopropylphosphonate,acetonylphosphonic acid diethyl ester,2-oxopropyl phosphonic acid diethyl ester,phosphonic acid, 2-oxopropyl-, diethyl ester,aurora ka-1476,ksc490a4t,diethyl acetylmethylphosphonate PubChem CID: 14028 IUPAC Name: 1-diethoxyphosphorylpropan-2-one SMILES: CCOP(=O)(CC(=O)C)OCC

PubChem CID | 14028 |
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CAS | 1067-71-6 |
Molecular Weight (g/mol) | 198.2 |
MDL Number | MFCD00044728 |
SMILES | CCOP(=O)(CC(=O)C)OCC |
Synonym | diethyl 2-oxopropyl phosphonate,diethyl acetonylphosphonate,diethyl 2-oxopropylphosphonate,acetonylphosphonic acid diethyl ester,2-oxopropyl phosphonic acid diethyl ester,phosphonic acid, 2-oxopropyl-, diethyl ester,aurora ka-1476,ksc490a4t,diethyl acetylmethylphosphonate |
IUPAC Name | 1-diethoxyphosphorylpropan-2-one |
InChI Key | RSAFKRSMGOSHRK-UHFFFAOYSA-N |
Molecular Formula | C7H19O4P |
3-Pyridinepropionic acid, 97%
CAS: 3724-19-4 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.16 MDL Number: MFCD00274197 InChI Key: WDGXIUUWINKTGP-UHFFFAOYSA-N Synonym: 3-3-pyridyl propionic acid,3-pyridinepropionic acid,3-pyridinepropanoic acid,3-pyridin-3-yl propanoic acid,3-3-pyridyl propionicacid,pyridine-3-propionic acid,3-3-pyridyl propanoic acid,3-pyridin-3-yl propionic acid,pubchem8701,maybridge4_001332 PubChem CID: 259624 IUPAC Name: 3-pyridin-3-ylpropanoic acid SMILES: C1=CC(=CN=C1)CCC(=O)O

PubChem CID | 259624 |
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CAS | 3724-19-4 |
Molecular Weight (g/mol) | 151.16 |
MDL Number | MFCD00274197 |
SMILES | C1=CC(=CN=C1)CCC(=O)O |
Synonym | 3-3-pyridyl propionic acid,3-pyridinepropionic acid,3-pyridinepropanoic acid,3-pyridin-3-yl propanoic acid,3-3-pyridyl propionicacid,pyridine-3-propionic acid,3-3-pyridyl propanoic acid,3-pyridin-3-yl propionic acid,pubchem8701,maybridge4_001332 |
IUPAC Name | 3-pyridin-3-ylpropanoic acid |
InChI Key | WDGXIUUWINKTGP-UHFFFAOYSA-N |
Molecular Formula | C8H9NO2 |
Methyl diethylphosphonoacetate, 97%
CAS: 1067-74-9 Molecular Formula: C7H15O5P Molecular Weight (g/mol): 210.17 MDL Number: MFCD00009081 InChI Key: CTSAXXHOGZNKJR-UHFFFAOYSA-N Synonym: methyl diethylphosphonoacetate,methyl 2-diethoxyphosphoryl acetate,acetic acid, diethoxyphosphinyl-, methyl ester,diethylmethylphosphonoacetate,methyl diethoxyphosphoryl acetate,diethyl carbomethoxymethylphosphonate,methyl 2-diethoxycarbonyl acetate,methyldiethylphosphonoacetate,diethyl methylphosphonoacetate,ksc489e0f PubChem CID: 66113 IUPAC Name: methyl 2-diethoxyphosphorylacetate SMILES: CCOP(=O)(CC(=O)OC)OCC

PubChem CID | 66113 |
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CAS | 1067-74-9 |
Molecular Weight (g/mol) | 210.17 |
MDL Number | MFCD00009081 |
SMILES | CCOP(=O)(CC(=O)OC)OCC |
Synonym | methyl diethylphosphonoacetate,methyl 2-diethoxyphosphoryl acetate,acetic acid, diethoxyphosphinyl-, methyl ester,diethylmethylphosphonoacetate,methyl diethoxyphosphoryl acetate,diethyl carbomethoxymethylphosphonate,methyl 2-diethoxycarbonyl acetate,methyldiethylphosphonoacetate,diethyl methylphosphonoacetate,ksc489e0f |
IUPAC Name | methyl 2-diethoxyphosphorylacetate |
InChI Key | CTSAXXHOGZNKJR-UHFFFAOYSA-N |
Molecular Formula | C7H15O5P |
Ethyl fluoroacetate, 97%, Thermo Scientific Chemicals
CAS: 459-72-3 Molecular Formula: C4H7FO2 Molecular Weight (g/mol): 106.1 MDL Number: MFCD00000450 InChI Key: VCYZVXRKYPKDQB-UHFFFAOYSA-N Synonym: ethyl fluoroacetate,ethyl monofluoroacetate,acetic acid, fluoro-, ethyl ester,fluoroacetic acid ethyl ester,unii-aus1l6um7b,ethylester kyseliny fluoroctove,monofluoroacetic acid ethyl ester,aus1l6um7b,ethylester kyseliny fluoroctove czech,acetic acid, 2-fluoro-, ethyl ester PubChem CID: 9988 IUPAC Name: ethyl 2-fluoroacetate SMILES: CCOC(=O)CF

PubChem CID | 9988 |
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CAS | 459-72-3 |
Molecular Weight (g/mol) | 106.1 |
MDL Number | MFCD00000450 |
SMILES | CCOC(=O)CF |
Synonym | ethyl fluoroacetate,ethyl monofluoroacetate,acetic acid, fluoro-, ethyl ester,fluoroacetic acid ethyl ester,unii-aus1l6um7b,ethylester kyseliny fluoroctove,monofluoroacetic acid ethyl ester,aus1l6um7b,ethylester kyseliny fluoroctove czech,acetic acid, 2-fluoro-, ethyl ester |
IUPAC Name | ethyl 2-fluoroacetate |
InChI Key | VCYZVXRKYPKDQB-UHFFFAOYSA-N |
Molecular Formula | C4H7FO2 |
N-(3-Bromopropyl)phthalimide, 98%
CAS: 5460-29-7 Molecular Formula: C11H10BrNO2 Molecular Weight (g/mol): 268.1 MDL Number: MFCD00005904 InChI Key: VKJCJJYNVIYVQR-UHFFFAOYSA-N Synonym: n-3-bromopropyl phthalimide,2-3-bromopropyl isoindoline-1,3-dione,1-phthalimido-3-bromopropane,3-bromopropylphthalimide,n-3-bromopropylphthalimide,gamma-bromopropylphthalimide,2-3-bromopropyl-1h-isoindole-1,3 2h-dione,2-3-bromopropyl-2,3-dihydro-1h-isoindole-1,3-dione,phthalimide, n-3-bromopropyl,1h-isoindole-1,3 2h-dione, 2-3-bromopropyl PubChem CID: 21611 IUPAC Name: 2-(3-bromopropyl)isoindole-1,3-dione SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)CCCBr

PubChem CID | 21611 |
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CAS | 5460-29-7 |
Molecular Weight (g/mol) | 268.1 |
MDL Number | MFCD00005904 |
SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CCCBr |
Synonym | n-3-bromopropyl phthalimide,2-3-bromopropyl isoindoline-1,3-dione,1-phthalimido-3-bromopropane,3-bromopropylphthalimide,n-3-bromopropylphthalimide,gamma-bromopropylphthalimide,2-3-bromopropyl-1h-isoindole-1,3 2h-dione,2-3-bromopropyl-2,3-dihydro-1h-isoindole-1,3-dione,phthalimide, n-3-bromopropyl,1h-isoindole-1,3 2h-dione, 2-3-bromopropyl |
IUPAC Name | 2-(3-bromopropyl)isoindole-1,3-dione |
InChI Key | VKJCJJYNVIYVQR-UHFFFAOYSA-N |
Molecular Formula | C11H10BrNO2 |
tert-Butylacetic Acid, 98%
CAS: 1070-83-3 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00002715 InChI Key: MLMQPDHYNJCQAO-UHFFFAOYSA-N Synonym: 3,3-dimethylbutyric acid,tert-butylacetic acid,t-butylacetic acid,butanoic acid, 3,3-dimethyl,3,3-dimethyl-butanoic acid,unii-q80k0tzq55,butyric acid, 3,3-dimethyl,3,3-dimethyl-butyric acid,3,3-dimethyl-n-butyric acid,tert-butyric acid PubChem CID: 14057 ChEBI: CHEBI:38647 IUPAC Name: 3,3-dimethylbutanoic acid SMILES: CC(C)(C)CC(=O)O

PubChem CID | 14057 |
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CAS | 1070-83-3 |
Molecular Weight (g/mol) | 116.16 |
ChEBI | CHEBI:38647 |
MDL Number | MFCD00002715 |
SMILES | CC(C)(C)CC(=O)O |
Synonym | 3,3-dimethylbutyric acid,tert-butylacetic acid,t-butylacetic acid,butanoic acid, 3,3-dimethyl,3,3-dimethyl-butanoic acid,unii-q80k0tzq55,butyric acid, 3,3-dimethyl,3,3-dimethyl-butyric acid,3,3-dimethyl-n-butyric acid,tert-butyric acid |
IUPAC Name | 3,3-dimethylbutanoic acid |
InChI Key | MLMQPDHYNJCQAO-UHFFFAOYSA-N |
Molecular Formula | C6H12O2 |
Cyclopropanecarboxylic acid, 98%
CAS: 1759-53-1 Molecular Formula: C4H6O2 Molecular Weight (g/mol): 86.09 MDL Number: MFCD00001287 InChI Key: YMGUBTXCNDTFJI-UHFFFAOYSA-N Synonym: carboxycyclopropane,cyclopropylcarboxylic acid,cyclopropionic acid,cyclopropane carboxylic acid,cyclopropanecarboxylicacid,cpc-acid,cyclopropyl carboxylic acid,trimethylenecarboxylic acid,cyclopropane carboylic acid,cyclopropane-carboxylic acid PubChem CID: 15655 ChEBI: CHEBI:23500 IUPAC Name: cyclopropanecarboxylic acid SMILES: C1CC1C(=O)O

PubChem CID | 15655 |
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CAS | 1759-53-1 |
Molecular Weight (g/mol) | 86.09 |
ChEBI | CHEBI:23500 |
MDL Number | MFCD00001287 |
SMILES | C1CC1C(=O)O |
Synonym | carboxycyclopropane,cyclopropylcarboxylic acid,cyclopropionic acid,cyclopropane carboxylic acid,cyclopropanecarboxylicacid,cpc-acid,cyclopropyl carboxylic acid,trimethylenecarboxylic acid,cyclopropane carboylic acid,cyclopropane-carboxylic acid |
IUPAC Name | cyclopropanecarboxylic acid |
InChI Key | YMGUBTXCNDTFJI-UHFFFAOYSA-N |
Molecular Formula | C4H6O2 |
N,N-Dibutylformamide, 99+%, Thermo Scientific Chemicals
CAS: 761-65-9 Molecular Formula: C9H19NO Molecular Weight (g/mol): 157.26 MDL Number: MFCD00003289 InChI Key: NZMAJUHVSZBJHL-UHFFFAOYSA-N Synonym: dibutylformamide,formamide, n,n-dibutyl,n,n-di-n-butylformamide,formamide, n,n-di-n-butyl,dibutylamid kyseliny mravenci,dibutylamid kyseliny mravenci czech,formamide, dibutyl,n-formyldibutylamine,formamide,n-dibutyl,n,n-di-butylformamide PubChem CID: 12975 IUPAC Name: N,N-dibutylformamide SMILES: CCCCN(CCCC)C=O

PubChem CID | 12975 |
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CAS | 761-65-9 |
Molecular Weight (g/mol) | 157.26 |
MDL Number | MFCD00003289 |
SMILES | CCCCN(CCCC)C=O |
Synonym | dibutylformamide,formamide, n,n-dibutyl,n,n-di-n-butylformamide,formamide, n,n-di-n-butyl,dibutylamid kyseliny mravenci,dibutylamid kyseliny mravenci czech,formamide, dibutyl,n-formyldibutylamine,formamide,n-dibutyl,n,n-di-butylformamide |
IUPAC Name | N,N-dibutylformamide |
InChI Key | NZMAJUHVSZBJHL-UHFFFAOYSA-N |
Molecular Formula | C9H19NO |
Hypoxanthine, 99.5%
CAS: 68-94-0 Molecular Formula: C5H4N4O Molecular Weight (g/mol): 136.11 MDL Number: MFCD00005725 InChI Key: FDGQSTZJBFJUBT-UHFFFAOYSA-N Synonym: hypoxanthine,6-hydroxypurine,9h-purin-6-ol,sarkin,6-oxopurine,sarcine,sarkine,3h-purin-6-ol,7h-purin-6-ol,purin-6 1h-one PubChem CID: 790 ChEBI: CHEBI:17368 SMILES: O=C1N=CNC2=C1NC=N2

PubChem CID | 790 |
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CAS | 68-94-0 |
Molecular Weight (g/mol) | 136.11 |
ChEBI | CHEBI:17368 |
MDL Number | MFCD00005725 |
SMILES | O=C1N=CNC2=C1NC=N2 |
Synonym | hypoxanthine,6-hydroxypurine,9h-purin-6-ol,sarkin,6-oxopurine,sarcine,sarkine,3h-purin-6-ol,7h-purin-6-ol,purin-6 1h-one |
InChI Key | FDGQSTZJBFJUBT-UHFFFAOYSA-N |
Molecular Formula | C5H4N4O |
Mercaptoacetic acid, sodium salt, 98%
CAS: 367-51-1 Molecular Formula: C2H3NaO2S Molecular Weight (g/mol): 114.09 MDL Number: MFCD00043386 InChI Key: GNBVPFITFYNRCN-UHFFFAOYSA-M Synonym: sodium thioglycolate,sodium mercaptoacetate,mercaptoacetic acid sodium salt,mollescal sf,sodium 2-sulfanylacetate,thioglycolate sodium,sodium thioglycollate,mercaptoacetic acid, sodium salt,erhavit d,sodium 2-mercatoethanoate PubChem CID: 23690444 ChEBI: CHEBI:86481 IUPAC Name: sodium;2-sulfanylacetate SMILES: C(C(=O)[O-])S.[Na+]

PubChem CID | 23690444 |
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CAS | 367-51-1 |
Molecular Weight (g/mol) | 114.09 |
ChEBI | CHEBI:86481 |
MDL Number | MFCD00043386 |
SMILES | C(C(=O)[O-])S.[Na+] |
Synonym | sodium thioglycolate,sodium mercaptoacetate,mercaptoacetic acid sodium salt,mollescal sf,sodium 2-sulfanylacetate,thioglycolate sodium,sodium thioglycollate,mercaptoacetic acid, sodium salt,erhavit d,sodium 2-mercatoethanoate |
IUPAC Name | sodium;2-sulfanylacetate |
InChI Key | GNBVPFITFYNRCN-UHFFFAOYSA-M |
Molecular Formula | C2H3NaO2S |
1,2-Bis(2-aminophenoxy)-ethane-N,N,N'N'-tetraacetic acid, 97%
CAS: 85233-19-8 Molecular Formula: C22H24N2O10 Molecular Weight (g/mol): 476.44 MDL Number: MFCD00036255 InChI Key: FTEDXVNDVHYDQW-UHFFFAOYSA-N Synonym: bapta,bapeta,1,2-bis 2-aminophenoxy ethane-n,n,n',n'-tetraacetic acid,ca ii-bapta,1,2-bis-2-aminophenoxy ethane n,n,n',n'-tetraacetic acid,unii-k22ddw77c0,1,2-bis o-aminophenoxy ethane-n,n,n',n'-tetraacetic acid,bapta tetrasodium salt hydrate,glycine, n,n'-1,2-ethanediylbis oxy-2,1-phenylene bis n-carboxymethyl,2,2',2,2'-ethane-1,2-diylbis oxy-2,1-phenylenenitrilo tetraacetic acid PubChem CID: 104751 ChEBI: CHEBI:60888 IUPAC Name: 2-{[2-(2-{2-[bis(carboxymethyl)amino]phenoxy}ethoxy)phenyl](carboxymethyl)amino}acetic acid SMILES: OC(=O)CN(CC(O)=O)C1=CC=CC=C1OCCOC1=CC=CC=C1N(CC(O)=O)CC(O)=O

PubChem CID | 104751 |
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CAS | 85233-19-8 |
Molecular Weight (g/mol) | 476.44 |
ChEBI | CHEBI:60888 |
MDL Number | MFCD00036255 |
SMILES | OC(=O)CN(CC(O)=O)C1=CC=CC=C1OCCOC1=CC=CC=C1N(CC(O)=O)CC(O)=O |
Synonym | bapta,bapeta,1,2-bis 2-aminophenoxy ethane-n,n,n',n'-tetraacetic acid,ca ii-bapta,1,2-bis-2-aminophenoxy ethane n,n,n',n'-tetraacetic acid,unii-k22ddw77c0,1,2-bis o-aminophenoxy ethane-n,n,n',n'-tetraacetic acid,bapta tetrasodium salt hydrate,glycine, n,n'-1,2-ethanediylbis oxy-2,1-phenylene bis n-carboxymethyl,2,2',2,2'-ethane-1,2-diylbis oxy-2,1-phenylenenitrilo tetraacetic acid |
IUPAC Name | 2-{[2-(2-{2-[bis(carboxymethyl)amino]phenoxy}ethoxy)phenyl](carboxymethyl)amino}acetic acid |
InChI Key | FTEDXVNDVHYDQW-UHFFFAOYSA-N |
Molecular Formula | C22H24N2O10 |
Ethyl 4-bromocrotonate, 75%, tech.
CAS: 37746-78-4 Molecular Formula: C6H9BrO2 Molecular Weight (g/mol): 193.04 MDL Number: MFCD00000247 InChI Key: FHGRPBSDPBRTLS-ONEGZZNKSA-N Synonym: ethyl 4-bromocrotonate,e-ethyl 4-bromobut-2-enoate,ethyl 4-bromobut-2-enoate,4-bromocrotonic acid ethyl ester,ethyl 2e-4-bromobut-2-enoate,2-butenoic acid, 4-bromo-, ethyl ester, e,2-butenoic acid, 4-bromo-, ethyl ester,ethyl e-4-bromo-2-butenoate,ethyl e-4-bromobut-2-enoate,ethyl trans-4-bromo-2-butenoate PubChem CID: 5373944 IUPAC Name: ethyl (E)-4-bromobut-2-enoate SMILES: CCOC(=O)C=CCBr

PubChem CID | 5373944 |
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CAS | 37746-78-4 |
Molecular Weight (g/mol) | 193.04 |
MDL Number | MFCD00000247 |
SMILES | CCOC(=O)C=CCBr |
Synonym | ethyl 4-bromocrotonate,e-ethyl 4-bromobut-2-enoate,ethyl 4-bromobut-2-enoate,4-bromocrotonic acid ethyl ester,ethyl 2e-4-bromobut-2-enoate,2-butenoic acid, 4-bromo-, ethyl ester, e,2-butenoic acid, 4-bromo-, ethyl ester,ethyl e-4-bromo-2-butenoate,ethyl e-4-bromobut-2-enoate,ethyl trans-4-bromo-2-butenoate |
IUPAC Name | ethyl (E)-4-bromobut-2-enoate |
InChI Key | FHGRPBSDPBRTLS-ONEGZZNKSA-N |
Molecular Formula | C6H9BrO2 |