
Carboxylic acids and derivatives















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Ethyl tetradecanoate, 98%
CAS: 124-06-1 Molecular Formula: C16H32O2 Molecular Weight (g/mol): 256.43 MDL Number: MFCD00008984 InChI Key: MMKRHZKQPFCLLS-UHFFFAOYSA-N Synonym: ethyl myristate,tetradecanoic acid, ethyl ester,myristic acid ethyl ester,myristic acid, ethyl ester,ethylmyristate,ethyl n-tetradecanoate,ethyl myristate natural,fema no. 2445,tetradecanoic acid ethyl ester,ethyl ester tetradecanoic acid PubChem CID: 31283 ChEBI: CHEBI:84849 IUPAC Name: ethyl tetradecanoate SMILES: CCCCCCCCCCCCCC(=O)OCC
PubChem CID | 31283 |
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CAS | 124-06-1 |
Molecular Weight (g/mol) | 256.43 |
ChEBI | CHEBI:84849 |
MDL Number | MFCD00008984 |
SMILES | CCCCCCCCCCCCCC(=O)OCC |
Synonym | ethyl myristate,tetradecanoic acid, ethyl ester,myristic acid ethyl ester,myristic acid, ethyl ester,ethylmyristate,ethyl n-tetradecanoate,ethyl myristate natural,fema no. 2445,tetradecanoic acid ethyl ester,ethyl ester tetradecanoic acid |
IUPAC Name | ethyl tetradecanoate |
InChI Key | MMKRHZKQPFCLLS-UHFFFAOYSA-N |
Molecular Formula | C16H32O2 |
2-Bromoacetamide, 98%
CAS: 683-57-8 Molecular Formula: C2H4BrNO Molecular Weight (g/mol): 137.964 MDL Number: MFCD00008025 InChI Key: JUIKUQOUMZUFQT-UHFFFAOYSA-N Synonym: bromoacetamide,acetamide, 2-bromo,2-bromo-acetamide,alpha-bromoacetamide,bromacetamide,bromoacetoamide,bromo acetamide,2-bromoacetoamide,2-bromo acetamide,sjyhcabiktp@ PubChem CID: 69632 IUPAC Name: 2-bromoacetamide SMILES: C(C(=O)N)Br
PubChem CID | 69632 |
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CAS | 683-57-8 |
Molecular Weight (g/mol) | 137.964 |
MDL Number | MFCD00008025 |
SMILES | C(C(=O)N)Br |
Synonym | bromoacetamide,acetamide, 2-bromo,2-bromo-acetamide,alpha-bromoacetamide,bromacetamide,bromoacetoamide,bromo acetamide,2-bromoacetoamide,2-bromo acetamide,sjyhcabiktp@ |
IUPAC Name | 2-bromoacetamide |
InChI Key | JUIKUQOUMZUFQT-UHFFFAOYSA-N |
Molecular Formula | C2H4BrNO |
Ethyl 3-phenylpropionate, 98+%
CAS: 2021-28-5 Molecular Formula: C11H14O2 Molecular Weight (g/mol): 178.231 MDL Number: MFCD00009206 InChI Key: JAGZUIGGHGTFHO-UHFFFAOYSA-N Synonym: ethyl 3-phenylpropionate,ethyl hydrocinnamate,ethyl dihydrocinnamate,benzenepropanoic acid, ethyl ester,3-phenylpropionic acid ethyl ester,hydrocinnamic acid, ethyl ester,ethylhydrocinnamoate,ethyl benzenepropanoate,unii-58e9z9v64d,ethylphenyl propanoate PubChem CID: 16237 IUPAC Name: ethyl 3-phenylpropanoate SMILES: CCOC(=O)CCC1=CC=CC=C1
PubChem CID | 16237 |
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CAS | 2021-28-5 |
Molecular Weight (g/mol) | 178.231 |
MDL Number | MFCD00009206 |
SMILES | CCOC(=O)CCC1=CC=CC=C1 |
Synonym | ethyl 3-phenylpropionate,ethyl hydrocinnamate,ethyl dihydrocinnamate,benzenepropanoic acid, ethyl ester,3-phenylpropionic acid ethyl ester,hydrocinnamic acid, ethyl ester,ethylhydrocinnamoate,ethyl benzenepropanoate,unii-58e9z9v64d,ethylphenyl propanoate |
IUPAC Name | ethyl 3-phenylpropanoate |
InChI Key | JAGZUIGGHGTFHO-UHFFFAOYSA-N |
Molecular Formula | C11H14O2 |
2-Naphthylacetic acid, 99%
CAS: 581-96-4 Molecular Formula: C12H10O2 Molecular Weight (g/mol): 186.21 MDL Number: MFCD00004126 InChI Key: VIBOGIYPPWLDTI-UHFFFAOYSA-N Synonym: 2-naphthylacetic acid,2-naphthaleneacetic acid,2-naphthalen-2-yl acetic acid,betoxan,2-2-naphthyl acetic acid,beta-naphthylacetic acid,beta-naphthaleneacetic acid,beta-naphthaleneacetate,naphthalen-2-ylacetic acid,.beta.-naphthaleneacetic acid PubChem CID: 11393 ChEBI: CHEBI:37837 IUPAC Name: 2-naphthalen-2-ylacetic acid SMILES: OC(=O)CC1=CC=C2C=CC=CC2=C1
PubChem CID | 11393 |
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CAS | 581-96-4 |
Molecular Weight (g/mol) | 186.21 |
ChEBI | CHEBI:37837 |
MDL Number | MFCD00004126 |
SMILES | OC(=O)CC1=CC=C2C=CC=CC2=C1 |
Synonym | 2-naphthylacetic acid,2-naphthaleneacetic acid,2-naphthalen-2-yl acetic acid,betoxan,2-2-naphthyl acetic acid,beta-naphthylacetic acid,beta-naphthaleneacetic acid,beta-naphthaleneacetate,naphthalen-2-ylacetic acid,.beta.-naphthaleneacetic acid |
IUPAC Name | 2-naphthalen-2-ylacetic acid |
InChI Key | VIBOGIYPPWLDTI-UHFFFAOYSA-N |
Molecular Formula | C12H10O2 |
2-Chloro-N,N-diethylacetamide, 97%
CAS: 2315-36-8 Molecular Formula: C6H12ClNO Molecular Weight (g/mol): 149.618 MDL Number: MFCD00000928 InChI Key: CQQUWTMMFMJEFE-UHFFFAOYSA-N Synonym: n,n-diethylchloroacetamide,cdea,acetamide, 2-chloro-n,n-diethyl,n,n-diethyl-2-chloroacetamide,n-chloroacetyldiethylamine,caswell no. 333g,diethylamid kyseliny chloroctove,alpha-chloro-n,n-diethylacetamide,.alpha.-chloro-n,n-diethylacetamide,n,n,-diethylchloroacetamide PubChem CID: 16844 IUPAC Name: 2-chloro-N,N-diethylacetamide SMILES: CCN(CC)C(=O)CCl
PubChem CID | 16844 |
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CAS | 2315-36-8 |
Molecular Weight (g/mol) | 149.618 |
MDL Number | MFCD00000928 |
SMILES | CCN(CC)C(=O)CCl |
Synonym | n,n-diethylchloroacetamide,cdea,acetamide, 2-chloro-n,n-diethyl,n,n-diethyl-2-chloroacetamide,n-chloroacetyldiethylamine,caswell no. 333g,diethylamid kyseliny chloroctove,alpha-chloro-n,n-diethylacetamide,.alpha.-chloro-n,n-diethylacetamide,n,n,-diethylchloroacetamide |
IUPAC Name | 2-chloro-N,N-diethylacetamide |
InChI Key | CQQUWTMMFMJEFE-UHFFFAOYSA-N |
Molecular Formula | C6H12ClNO |
Methyl 4-bromocrotonate, tech. 85%
CAS: 1117-71-1 Molecular Formula: C5H7BrO2 Molecular Weight (g/mol): 179.01 MDL Number: MFCD00000246,MFCD09998308 InChI Key: RWIKCBHOVNDESJ-NSCUHMNNSA-N Synonym: methyl 4-bromocrotonate,e-methyl 4-bromobut-2-enoate,4-bromocrotonic acid methyl ester,methyl gamma-bromocrotonate,methyl bromocrotonate,methyl 4-bromo-2-butenoate,2-butenoic acid, 4-bromo-, methyl ester,methyl 4-bromobut-2-enoate,methyl 2e-4-bromobut-2-enoate,crotonic acid, 4-bromo-, methyl ester PubChem CID: 5369175 IUPAC Name: methyl (E)-4-bromobut-2-enoate SMILES: COC(=O)\C=C\CBr
PubChem CID | 5369175 |
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CAS | 1117-71-1 |
Molecular Weight (g/mol) | 179.01 |
MDL Number | MFCD00000246,MFCD09998308 |
SMILES | COC(=O)\C=C\CBr |
Synonym | methyl 4-bromocrotonate,e-methyl 4-bromobut-2-enoate,4-bromocrotonic acid methyl ester,methyl gamma-bromocrotonate,methyl bromocrotonate,methyl 4-bromo-2-butenoate,2-butenoic acid, 4-bromo-, methyl ester,methyl 4-bromobut-2-enoate,methyl 2e-4-bromobut-2-enoate,crotonic acid, 4-bromo-, methyl ester |
IUPAC Name | methyl (E)-4-bromobut-2-enoate |
InChI Key | RWIKCBHOVNDESJ-NSCUHMNNSA-N |
Molecular Formula | C5H7BrO2 |
Ethyl palmitate, 97%
CAS: 628-97-7 Molecular Formula: C18H36O2 Molecular Weight (g/mol): 284.48 MDL Number: MFCD00008996 InChI Key: XIRNKXNNONJFQO-UHFFFAOYSA-N Synonym: ethyl palmitate,hexadecanoic acid, ethyl ester,palmitic acid ethyl ester,ethyl cetylate,palmitic acid, ethyl ester,ethylpalmitate,unii-ird3m534zm,hexadecanoic acid ethyl ester,ethyl n-hexadecanoate,ird3m534zm PubChem CID: 12366 ChEBI: CHEBI:84932 IUPAC Name: ethyl hexadecanoate SMILES: CCCCCCCCCCCCCCCC(=O)OCC
PubChem CID | 12366 |
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CAS | 628-97-7 |
Molecular Weight (g/mol) | 284.48 |
ChEBI | CHEBI:84932 |
MDL Number | MFCD00008996 |
SMILES | CCCCCCCCCCCCCCCC(=O)OCC |
Synonym | ethyl palmitate,hexadecanoic acid, ethyl ester,palmitic acid ethyl ester,ethyl cetylate,palmitic acid, ethyl ester,ethylpalmitate,unii-ird3m534zm,hexadecanoic acid ethyl ester,ethyl n-hexadecanoate,ird3m534zm |
IUPAC Name | ethyl hexadecanoate |
InChI Key | XIRNKXNNONJFQO-UHFFFAOYSA-N |
Molecular Formula | C18H36O2 |
1,3,5-Benzenetricarboxylic acid, 98%
CAS: 554-95-0 Molecular Formula: C9H6O6 Molecular Weight (g/mol): 210.14 MDL Number: MFCD00002517 InChI Key: QMKYBPDZANOJGF-UHFFFAOYSA-N Synonym: trimesic acid,1,3,5-benzenetricarboxylic acid,trimesinic acid,trimesitinic acid,5-carboxyisophthalic acid,1,3,5-benzene tricarboxylic acid,1,3,5-tricarboxybenzene,unii-ou36oo5mtn,ou36oo5mtn,chembl77562 PubChem CID: 11138 ChEBI: CHEBI:46032 IUPAC Name: benzene-1,3,5-tricarboxylic acid SMILES: OC(=O)C1=CC(=CC(=C1)C(O)=O)C(O)=O
PubChem CID | 11138 |
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CAS | 554-95-0 |
Molecular Weight (g/mol) | 210.14 |
ChEBI | CHEBI:46032 |
MDL Number | MFCD00002517 |
SMILES | OC(=O)C1=CC(=CC(=C1)C(O)=O)C(O)=O |
Synonym | trimesic acid,1,3,5-benzenetricarboxylic acid,trimesinic acid,trimesitinic acid,5-carboxyisophthalic acid,1,3,5-benzene tricarboxylic acid,1,3,5-tricarboxybenzene,unii-ou36oo5mtn,ou36oo5mtn,chembl77562 |
IUPAC Name | benzene-1,3,5-tricarboxylic acid |
InChI Key | QMKYBPDZANOJGF-UHFFFAOYSA-N |
Molecular Formula | C9H6O6 |
n-Butyl L-lactate, 97+%
CAS: 34451-19-9 Molecular Formula: C7H14O3 Molecular Weight (g/mol): 146.19 MDL Number: MFCD00004519,MFCD00066454 InChI Key: MRABAEUHTLLEML-UHFFFAOYNA-N PubChem CID: 6999977 IUPAC Name: butyl (2S)-2-hydroxypropanoate SMILES: CCCCOC(=O)C(C)O
PubChem CID | 6999977 |
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CAS | 34451-19-9 |
Molecular Weight (g/mol) | 146.19 |
MDL Number | MFCD00004519,MFCD00066454 |
SMILES | CCCCOC(=O)C(C)O |
IUPAC Name | butyl (2S)-2-hydroxypropanoate |
InChI Key | MRABAEUHTLLEML-UHFFFAOYNA-N |
Molecular Formula | C7H14O3 |
2-Nitrobenzamide, 98%
CAS: 610-15-1 Molecular Formula: C7H6N2O3 Molecular Weight (g/mol): 166.136 MDL Number: MFCD00007976 InChI Key: KLGQWSOYKYFBTR-UHFFFAOYSA-N Synonym: o-nitrobenzamide,benzamide, o-nitro,benzamide, 2-nitro,2-carbamoylnitrobenzene,nitrobenzamide,nitro-benzamide,2-nitro-benzamide,benzamide,2-nitro,benzmide, 2-nitro,wln: zvr bnw PubChem CID: 11876 IUPAC Name: 2-nitrobenzamide SMILES: C1=CC=C(C(=C1)C(=O)N)[N+](=O)[O-]
PubChem CID | 11876 |
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CAS | 610-15-1 |
Molecular Weight (g/mol) | 166.136 |
MDL Number | MFCD00007976 |
SMILES | C1=CC=C(C(=C1)C(=O)N)[N+](=O)[O-] |
Synonym | o-nitrobenzamide,benzamide, o-nitro,benzamide, 2-nitro,2-carbamoylnitrobenzene,nitrobenzamide,nitro-benzamide,2-nitro-benzamide,benzamide,2-nitro,benzmide, 2-nitro,wln: zvr bnw |
IUPAC Name | 2-nitrobenzamide |
InChI Key | KLGQWSOYKYFBTR-UHFFFAOYSA-N |
Molecular Formula | C7H6N2O3 |
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 |
3-(2-Methoxyphenyl)propionic acid, 98+%
CAS: 6342-77-4 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00002772 InChI Key: XSZSNLOPIWWFHS-UHFFFAOYSA-N Synonym: 3-2-methoxyphenyl propanoic acid,3-2-methoxyphenyl propionic acid,2-methoxyhydrocinnamic acid,benzenepropanoic acid, 2-methoxy,o-methoxyhydrocinnamic acid,3-o-methoxyphenyl propionic acid,2-methoxy-benzenepropanoic acid,beta-o-methoxyphenyl propionic acid,acmc-209nfi,maybridge1_000611 PubChem CID: 80652 IUPAC Name: 3-(2-methoxyphenyl)propanoic acid SMILES: COC1=CC=CC=C1CCC(=O)O
PubChem CID | 80652 |
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CAS | 6342-77-4 |
Molecular Weight (g/mol) | 180.203 |
MDL Number | MFCD00002772 |
SMILES | COC1=CC=CC=C1CCC(=O)O |
Synonym | 3-2-methoxyphenyl propanoic acid,3-2-methoxyphenyl propionic acid,2-methoxyhydrocinnamic acid,benzenepropanoic acid, 2-methoxy,o-methoxyhydrocinnamic acid,3-o-methoxyphenyl propionic acid,2-methoxy-benzenepropanoic acid,beta-o-methoxyphenyl propionic acid,acmc-209nfi,maybridge1_000611 |
IUPAC Name | 3-(2-methoxyphenyl)propanoic acid |
InChI Key | XSZSNLOPIWWFHS-UHFFFAOYSA-N |
Molecular Formula | C10H12O3 |
Cyclobutanecarboxylic acid, 97%
CAS: 3721-95-7 Molecular Formula: C5H8O2 Molecular Weight (g/mol): 100.12 MDL Number: MFCD00001323 InChI Key: TXWOGHSRPAYOML-UHFFFAOYSA-N Synonym: cyclobutylcarboxylic acid,cyclo-butyl formic acid,cyclobutane carboxylic acid,unii-0rdj7c51o0,pubchem14139,acmc-1cnqb,cyclobutan carboxylic acid,cyclobutyl carboxylic acid,cyclobutancecarboxylic acid,cyclobutane-carboxylic acid PubChem CID: 19494 IUPAC Name: cyclobutanecarboxylic acid SMILES: OC(=O)C1CCC1
PubChem CID | 19494 |
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CAS | 3721-95-7 |
Molecular Weight (g/mol) | 100.12 |
MDL Number | MFCD00001323 |
SMILES | OC(=O)C1CCC1 |
Synonym | cyclobutylcarboxylic acid,cyclo-butyl formic acid,cyclobutane carboxylic acid,unii-0rdj7c51o0,pubchem14139,acmc-1cnqb,cyclobutan carboxylic acid,cyclobutyl carboxylic acid,cyclobutancecarboxylic acid,cyclobutane-carboxylic acid |
IUPAC Name | cyclobutanecarboxylic acid |
InChI Key | TXWOGHSRPAYOML-UHFFFAOYSA-N |
Molecular Formula | C5H8O2 |
2,2,3,3-d(4)-3-(Trimethylsilyl)propionic acid sodium salt, 98+ atom % D
CAS: 24493-21-8 Molecular Formula: C6H13NaO2Si Molecular Weight (g/mol): 172.267 MDL Number: MFCD00002762 InChI Key: OIIWPAYIXDCDNL-HGFPCDIYSA-M Synonym: sodium 3-trimethylsilyl 2,2,3,3-2h4 propionate,3-trimethylsilyl propionic acid-d4 sodium salt,2,2,3,3-d4-3-trimethylsilyl propionic acid sodium salt,sodium 3-trimethylsilyl 2 h? propanoate,sodium 3-trimethylsilyl 2h4 propanoate,tsp-d4,propanoic-2,2,3,3-d4 acid, 3-trimethylsilyl-, sodium salt,sodium 3-trimethylsilyl propionate-2,2,3,3-d4,3-trimethylsilyl propionic-2,2,3,3-d4 acid sodium salt,sodium-3-trimethylsilyl-2,2,3,3-tetradeuteriopropionate PubChem CID: 23688921 IUPAC Name: sodium;2,2,3,3-tetradeuterio-3-trimethylsilylpropanoate SMILES: C[Si](C)(C)CCC(=O)[O-].[Na+]
PubChem CID | 23688921 |
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CAS | 24493-21-8 |
Molecular Weight (g/mol) | 172.267 |
MDL Number | MFCD00002762 |
SMILES | C[Si](C)(C)CCC(=O)[O-].[Na+] |
Synonym | sodium 3-trimethylsilyl 2,2,3,3-2h4 propionate,3-trimethylsilyl propionic acid-d4 sodium salt,2,2,3,3-d4-3-trimethylsilyl propionic acid sodium salt,sodium 3-trimethylsilyl 2 h? propanoate,sodium 3-trimethylsilyl 2h4 propanoate,tsp-d4,propanoic-2,2,3,3-d4 acid, 3-trimethylsilyl-, sodium salt,sodium 3-trimethylsilyl propionate-2,2,3,3-d4,3-trimethylsilyl propionic-2,2,3,3-d4 acid sodium salt,sodium-3-trimethylsilyl-2,2,3,3-tetradeuteriopropionate |
IUPAC Name | sodium;2,2,3,3-tetradeuterio-3-trimethylsilylpropanoate |
InChI Key | OIIWPAYIXDCDNL-HGFPCDIYSA-M |
Molecular Formula | C6H13NaO2Si |
Methyl carbazate, 98%
CAS: 6294-89-9 Molecular Formula: C2H6N2O2 Molecular Weight (g/mol): 90.08 MDL Number: MFCD00007594 InChI Key: WFJRIDQGVSJLLH-UHFFFAOYSA-N Synonym: methyl carbazate,methyl hydrazinecarboxylate,methyl hydrazinocarboxylate,methoxycarbohydrazide,methylcarbazate,hydrazinecarboxylic acid, methyl ester,carbomethoxyhydrazide,methyl hydrazinoformate,methoxycarbonyl hydrazine,carbazic acid methyl ester PubChem CID: 80519 IUPAC Name: methyl N-aminocarbamate SMILES: COC(=O)NN
PubChem CID | 80519 |
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CAS | 6294-89-9 |
Molecular Weight (g/mol) | 90.08 |
MDL Number | MFCD00007594 |
SMILES | COC(=O)NN |
Synonym | methyl carbazate,methyl hydrazinecarboxylate,methyl hydrazinocarboxylate,methoxycarbohydrazide,methylcarbazate,hydrazinecarboxylic acid, methyl ester,carbomethoxyhydrazide,methyl hydrazinoformate,methoxycarbonyl hydrazine,carbazic acid methyl ester |
IUPAC Name | methyl N-aminocarbamate |
InChI Key | WFJRIDQGVSJLLH-UHFFFAOYSA-N |
Molecular Formula | C2H6N2O2 |