
Carboxylic acids and derivatives















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MilliporeSigma™ BAPTA, Tetra sodium Salt, Calbiochem™,
CAS: 126824-24-6 Molecular Formula: C22H20N2Na4O10 Molecular Weight (g/mol): 564.37 MDL Number: MFCD02683087 InChI Key: ZWSMLJACYSGFKD-UHFFFAOYSA-J Synonym: bapta-na4,bapta tetrasodium,bapta tetrasodium salt,sodium 2,2',2,2'-ethane-1,2-diylbis oxy bis 2,1-phenylene bis azanetriyl tetraacetate,bapta, tetrasodium salt,bapta tetrasodium salt hydrate,1,2-bis 2-aminophenoxy ethane-n,n,n',n'-tetraacetic acid tetrasodium salt,tetrasodium 1,2-bis 2-aminophenoxy ethane-n,n,n',n'-tetraacetate,1,2-bis 2-aminophenoxy-ethane-n,n,n, n-tetraacetic acid tetrasodium salt,1,2-bis 2-aminophenoxy ethane-n,n,n',n'-tetraacetic acid tetrasodium salt hplc PubChem CID: 2734965 IUPAC Name: tetrasodium 2-{[2-(2-{2-[bis(carboxylatomethyl)amino]phenoxy}ethoxy)phenyl](carboxylatomethyl)amino}acetate SMILES: [Na+].[Na+].[Na+].[Na+].[O-]C(=O)CN(CC([O-])=O)C1=CC=CC=C1OCCOC1=CC=CC=C1N(CC([O-])=O)CC([O-])=O
PubChem CID | 2734965 |
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CAS | 126824-24-6 |
Molecular Weight (g/mol) | 564.37 |
MDL Number | MFCD02683087 |
SMILES | [Na+].[Na+].[Na+].[Na+].[O-]C(=O)CN(CC([O-])=O)C1=CC=CC=C1OCCOC1=CC=CC=C1N(CC([O-])=O)CC([O-])=O |
Synonym | bapta-na4,bapta tetrasodium,bapta tetrasodium salt,sodium 2,2',2,2'-ethane-1,2-diylbis oxy bis 2,1-phenylene bis azanetriyl tetraacetate,bapta, tetrasodium salt,bapta tetrasodium salt hydrate,1,2-bis 2-aminophenoxy ethane-n,n,n',n'-tetraacetic acid tetrasodium salt,tetrasodium 1,2-bis 2-aminophenoxy ethane-n,n,n',n'-tetraacetate,1,2-bis 2-aminophenoxy-ethane-n,n,n, n-tetraacetic acid tetrasodium salt,1,2-bis 2-aminophenoxy ethane-n,n,n',n'-tetraacetic acid tetrasodium salt hplc |
IUPAC Name | tetrasodium 2-{[2-(2-{2-[bis(carboxylatomethyl)amino]phenoxy}ethoxy)phenyl](carboxylatomethyl)amino}acetate |
InChI Key | ZWSMLJACYSGFKD-UHFFFAOYSA-J |
Molecular Formula | C22H20N2Na4O10 |
MilliporeSigma™ Dihydrorhodamine 123, Calbiochem™,
CAS: 109244-58-8 Molecular Formula: C21H18N2O3 Molecular Weight (g/mol): 346.39 MDL Number: MFCD04221428 InChI Key: FNEZBBILNYNQGC-UHFFFAOYSA-N Synonym: dihydrorhodamine 123,dihydrorhodamine,methyl 2-3,6-diamino-9h-xanthen-9-yl benzoate,benzoic acid, 2-3,6-diamino-9h-xanthen-9-yl-, methyl ester,dihydrorhodamine-123 PubChem CID: 105032 IUPAC Name: methyl 2-(3,6-diamino-9H-xanthen-9-yl)benzoate SMILES: COC(=O)C1=CC=CC=C1C1C2=CC=C(N)C=C2OC2=CC(N)=CC=C12
PubChem CID | 105032 |
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CAS | 109244-58-8 |
Molecular Weight (g/mol) | 346.39 |
MDL Number | MFCD04221428 |
SMILES | COC(=O)C1=CC=CC=C1C1C2=CC=C(N)C=C2OC2=CC(N)=CC=C12 |
Synonym | dihydrorhodamine 123,dihydrorhodamine,methyl 2-3,6-diamino-9h-xanthen-9-yl benzoate,benzoic acid, 2-3,6-diamino-9h-xanthen-9-yl-, methyl ester,dihydrorhodamine-123 |
IUPAC Name | methyl 2-(3,6-diamino-9H-xanthen-9-yl)benzoate |
InChI Key | FNEZBBILNYNQGC-UHFFFAOYSA-N |
Molecular Formula | C21H18N2O3 |
2,2,2-Trifluoroacetamide, 97%
CAS: 354-38-1 Molecular Formula: C2H2F3NO Molecular Weight (g/mol): 113.04 MDL Number: MFCD00008008 InChI Key: NRKYWOKHZRQRJR-UHFFFAOYSA-N Synonym: trifluoroacetamide,acetamide, 2,2,2-trifluoro,unii-36mu16byfk,n-trifluoroacetamide,2,2,2-trifluoro-acetamide,36mu16byfk,trifluroacetamide,trifluoro-acetamide,snylgqhjptadtaetp@,pubchem12622 PubChem CID: 67717 IUPAC Name: 2,2,2-trifluoroacetamide SMILES: NC(=O)C(F)(F)F
PubChem CID | 67717 |
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CAS | 354-38-1 |
Molecular Weight (g/mol) | 113.04 |
MDL Number | MFCD00008008 |
SMILES | NC(=O)C(F)(F)F |
Synonym | trifluoroacetamide,acetamide, 2,2,2-trifluoro,unii-36mu16byfk,n-trifluoroacetamide,2,2,2-trifluoro-acetamide,36mu16byfk,trifluroacetamide,trifluoro-acetamide,snylgqhjptadtaetp@,pubchem12622 |
IUPAC Name | 2,2,2-trifluoroacetamide |
InChI Key | NRKYWOKHZRQRJR-UHFFFAOYSA-N |
Molecular Formula | C2H2F3NO |
Cyclohexanecarboxylic acid, 98%
CAS: 98-89-5 Molecular Formula: C7H12O2 Molecular Weight (g/mol): 128.171 MDL Number: MFCD00001461 InChI Key: NZNMSOFKMUBTKW-UHFFFAOYSA-N Synonym: hexahydrobenzoic acid,carboxycyclohexane,cyclohexanoic acid,cyclohexylcarboxylic acid,cyclohexylmethanoic acid,cyclohexylformic acid,benzoic acid, hexahydro,cyclohexancarbonsaeure,cyclohexane-1-carboxylate,cyclohexanecarboxylicacid PubChem CID: 7413 ChEBI: CHEBI:36096 IUPAC Name: cyclohexanecarboxylic acid SMILES: C1CCC(CC1)C(=O)O
PubChem CID | 7413 |
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CAS | 98-89-5 |
Molecular Weight (g/mol) | 128.171 |
ChEBI | CHEBI:36096 |
MDL Number | MFCD00001461 |
SMILES | C1CCC(CC1)C(=O)O |
Synonym | hexahydrobenzoic acid,carboxycyclohexane,cyclohexanoic acid,cyclohexylcarboxylic acid,cyclohexylmethanoic acid,cyclohexylformic acid,benzoic acid, hexahydro,cyclohexancarbonsaeure,cyclohexane-1-carboxylate,cyclohexanecarboxylicacid |
IUPAC Name | cyclohexanecarboxylic acid |
InChI Key | NZNMSOFKMUBTKW-UHFFFAOYSA-N |
Molecular Formula | C7H12O2 |
4-(p-Tolyl)butyric acid, 97%
CAS: 4521-22-6 Molecular Formula: C11H14O2 Molecular Weight (g/mol): 178.231 MDL Number: MFCD00021786 InChI Key: IXWOVMRDYFFXGI-UHFFFAOYSA-N Synonym: 4-p-tolyl butanoic acid,4-p-tolyl butyric acid,4-4-methylphenyl butanoic acid,benzenebutanoic acid, 4-methyl,4-p-tolylbutyric acid,4-para-tolyl-butyric acid,4-4-methylphenyl butyric acid,4-p-tolyl butanoicacid,4-p-tolylbutanoic acid,4-p-tolyl-butyric acid PubChem CID: 78279 IUPAC Name: 4-(4-methylphenyl)butanoic acid SMILES: CC1=CC=C(C=C1)CCCC(=O)O
PubChem CID | 78279 |
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CAS | 4521-22-6 |
Molecular Weight (g/mol) | 178.231 |
MDL Number | MFCD00021786 |
SMILES | CC1=CC=C(C=C1)CCCC(=O)O |
Synonym | 4-p-tolyl butanoic acid,4-p-tolyl butyric acid,4-4-methylphenyl butanoic acid,benzenebutanoic acid, 4-methyl,4-p-tolylbutyric acid,4-para-tolyl-butyric acid,4-4-methylphenyl butyric acid,4-p-tolyl butanoicacid,4-p-tolylbutanoic acid,4-p-tolyl-butyric acid |
IUPAC Name | 4-(4-methylphenyl)butanoic acid |
InChI Key | IXWOVMRDYFFXGI-UHFFFAOYSA-N |
Molecular Formula | C11H14O2 |
2-Phenoxyacetamide, 98%
CAS: 621-88-5 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.17 MDL Number: MFCD00017140 InChI Key: AOPRXJXHLWYPQR-UHFFFAOYSA-N Synonym: phenoxyacetamide,acetamide, 2-phenoxy,phenoxyacetic amide,alpha-phenoxyacetamide,2-phenoxyethanamide,2-phenoxy acetamide,pubchem12494,acmc-20ajx9,maybridge1_008727,po6 PubChem CID: 69314 IUPAC Name: 2-phenoxyacetamide SMILES: NC(=O)COC1=CC=CC=C1
PubChem CID | 69314 |
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CAS | 621-88-5 |
Molecular Weight (g/mol) | 151.17 |
MDL Number | MFCD00017140 |
SMILES | NC(=O)COC1=CC=CC=C1 |
Synonym | phenoxyacetamide,acetamide, 2-phenoxy,phenoxyacetic amide,alpha-phenoxyacetamide,2-phenoxyethanamide,2-phenoxy acetamide,pubchem12494,acmc-20ajx9,maybridge1_008727,po6 |
IUPAC Name | 2-phenoxyacetamide |
InChI Key | AOPRXJXHLWYPQR-UHFFFAOYSA-N |
Molecular Formula | C8H9NO2 |
1-Cyclohexene-1-carboxylic acid, 97%
CAS: 636-82-8 Molecular Formula: C7H10O2 Molecular Weight (g/mol): 126.155 MDL Number: MFCD00001545 InChI Key: NMEZJSDUZQOPFE-UHFFFAOYSA-N Synonym: 1-cyclohexene-1-carboxylic acid,1-cyclohexenecarboxylic acid,cyclohex-1-enecarboxylic acid,cyclohexenecarboxylic acid,cyclohex-1-ene-1-carboxylic acid,1-cyclohexenecarboxylicacid,cyclohexenyl carboxylic acid,1-cyclohexene carboxylic acid,acmc-1b731,3,4,5,6-tetrahydrobenzoic acid PubChem CID: 69470 ChEBI: CHEBI:29565 IUPAC Name: cyclohexene-1-carboxylic acid SMILES: C1CCC(=CC1)C(=O)O
PubChem CID | 69470 |
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CAS | 636-82-8 |
Molecular Weight (g/mol) | 126.155 |
ChEBI | CHEBI:29565 |
MDL Number | MFCD00001545 |
SMILES | C1CCC(=CC1)C(=O)O |
Synonym | 1-cyclohexene-1-carboxylic acid,1-cyclohexenecarboxylic acid,cyclohex-1-enecarboxylic acid,cyclohexenecarboxylic acid,cyclohex-1-ene-1-carboxylic acid,1-cyclohexenecarboxylicacid,cyclohexenyl carboxylic acid,1-cyclohexene carboxylic acid,acmc-1b731,3,4,5,6-tetrahydrobenzoic acid |
IUPAC Name | cyclohexene-1-carboxylic acid |
InChI Key | NMEZJSDUZQOPFE-UHFFFAOYSA-N |
Molecular Formula | C7H10O2 |
Methyl bromoacetate, 98+%
CAS: 96-32-2 Molecular Formula: C3H5BrO2 Molecular Weight (g/mol): 152.975 MDL Number: MFCD00000189 InChI Key: YDCHPLOFQATIDS-UHFFFAOYSA-N Synonym: methyl bromoacetate,bromoacetic acid methyl ester,methyl monobromoacetate,acetic acid, bromo-, methyl ester,methyl alpha-bromoacetate,methylbromoacetate,acetic acid, 2-bromo-, methyl ester,methylester kyseliny bromoctove,methyl .alpha.-bromoacetate,methylester kyseliny bromoctove czech PubChem CID: 60984 IUPAC Name: methyl 2-bromoacetate SMILES: COC(=O)CBr
PubChem CID | 60984 |
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CAS | 96-32-2 |
Molecular Weight (g/mol) | 152.975 |
MDL Number | MFCD00000189 |
SMILES | COC(=O)CBr |
Synonym | methyl bromoacetate,bromoacetic acid methyl ester,methyl monobromoacetate,acetic acid, bromo-, methyl ester,methyl alpha-bromoacetate,methylbromoacetate,acetic acid, 2-bromo-, methyl ester,methylester kyseliny bromoctove,methyl .alpha.-bromoacetate,methylester kyseliny bromoctove czech |
IUPAC Name | methyl 2-bromoacetate |
InChI Key | YDCHPLOFQATIDS-UHFFFAOYSA-N |
Molecular Formula | C3H5BrO2 |
Ethyl decanoate, 99%
CAS: 110-38-3 Molecular Formula: C12H24O2 Molecular Weight (g/mol): 200.322 MDL Number: MFCD00009581 InChI Key: RGXWDWUGBIJHDO-UHFFFAOYSA-N Synonym: ethyl caprate,ethyl caprinate,ethyl decylate,decanoic acid ethyl ester,decanoic acid, ethyl ester,capric acid ethyl ester,ethyl n-decanoate,capric acid, ethyl ester,natural,unii-gy39fb86uo PubChem CID: 8048 ChEBI: CHEBI:87430 IUPAC Name: ethyl decanoate SMILES: CCCCCCCCCC(=O)OCC
PubChem CID | 8048 |
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CAS | 110-38-3 |
Molecular Weight (g/mol) | 200.322 |
ChEBI | CHEBI:87430 |
MDL Number | MFCD00009581 |
SMILES | CCCCCCCCCC(=O)OCC |
Synonym | ethyl caprate,ethyl caprinate,ethyl decylate,decanoic acid ethyl ester,decanoic acid, ethyl ester,capric acid ethyl ester,ethyl n-decanoate,capric acid, ethyl ester,natural,unii-gy39fb86uo |
IUPAC Name | ethyl decanoate |
InChI Key | RGXWDWUGBIJHDO-UHFFFAOYSA-N |
Molecular Formula | C12H24O2 |
3-Amino-1-phenyl-2-pyrazolin-5-one, 97%
CAS: 4149-06-8 Molecular Formula: C9H9N3O Molecular Weight (g/mol): 175.19 MDL Number: MFCD00003137 InChI Key: LPOVZHYARSAVIZ-UHFFFAOYSA-N Synonym: 3-amino-1-phenyl-2-pyrazolin-5-one,3-amino-1-phenyl-1h-pyrazol-5 4h-one,3h-pyrazol-3-one, 5-amino-2,4-dihydro-2-phenyl,3-amino-1-phenyl-4,5-dihydro-1h-pyrazol-5-one,5-pyrazolone, 3-amino-1-phenyl,5-amino-2-phenyl-2,4-dihydro-3h-pyrazol-3-one,3h-pyrazol-3-one, 2,4-dihydro-5-amino-2-phenyl,2,4-dihydro-5-amino-2-phenyl-3h-pyrazol-3-one,acmc-1arey,lpovzhyarsaviz-uhfffaoysa PubChem CID: 77794 IUPAC Name: 5-amino-2-phenyl-4H-pyrazol-3-one SMILES: C1C(=NN(C1=O)C2=CC=CC=C2)N
PubChem CID | 77794 |
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CAS | 4149-06-8 |
Molecular Weight (g/mol) | 175.19 |
MDL Number | MFCD00003137 |
SMILES | C1C(=NN(C1=O)C2=CC=CC=C2)N |
Synonym | 3-amino-1-phenyl-2-pyrazolin-5-one,3-amino-1-phenyl-1h-pyrazol-5 4h-one,3h-pyrazol-3-one, 5-amino-2,4-dihydro-2-phenyl,3-amino-1-phenyl-4,5-dihydro-1h-pyrazol-5-one,5-pyrazolone, 3-amino-1-phenyl,5-amino-2-phenyl-2,4-dihydro-3h-pyrazol-3-one,3h-pyrazol-3-one, 2,4-dihydro-5-amino-2-phenyl,2,4-dihydro-5-amino-2-phenyl-3h-pyrazol-3-one,acmc-1arey,lpovzhyarsaviz-uhfffaoysa |
IUPAC Name | 5-amino-2-phenyl-4H-pyrazol-3-one |
InChI Key | LPOVZHYARSAVIZ-UHFFFAOYSA-N |
Molecular Formula | C9H9N3O |
Acetic hydrazide, 96%
CAS: 1068-57-1 Molecular Formula: C2H6N2O Molecular Weight (g/mol): 74.083 MDL Number: MFCD00007610 InChI Key: OFLXLNCGODUUOT-UHFFFAOYSA-N Synonym: acethydrazide,acetylhydrazine,acetic hydrazide,acetic acid hydrazide,acetyl hydrazide,monoacetylhydrazine,n-acetylhydrazine,ethanehydrazonic acid,acetic acid, hydrazide,acetyl hydrazine PubChem CID: 14039 ChEBI: CHEBI:48978 IUPAC Name: acetohydrazide SMILES: CC(=O)NN
PubChem CID | 14039 |
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CAS | 1068-57-1 |
Molecular Weight (g/mol) | 74.083 |
ChEBI | CHEBI:48978 |
MDL Number | MFCD00007610 |
SMILES | CC(=O)NN |
Synonym | acethydrazide,acetylhydrazine,acetic hydrazide,acetic acid hydrazide,acetyl hydrazide,monoacetylhydrazine,n-acetylhydrazine,ethanehydrazonic acid,acetic acid, hydrazide,acetyl hydrazine |
IUPAC Name | acetohydrazide |
InChI Key | OFLXLNCGODUUOT-UHFFFAOYSA-N |
Molecular Formula | C2H6N2O |
Benzohydroxamic acid, 98%
CAS: 495-18-1 Molecular Formula: C7H7NO2 Molecular Weight (g/mol): 137.138 MDL Number: MFCD00002109 InChI Key: VDEUYMSGMPQMIK-UHFFFAOYSA-N Synonym: benzohydroxamic acid,benzhydroxamic acid,benzamide, n-hydroxy,benzohydroxamate,phenylhydroxamic acid,benzohyroxamate,hydroxylamine, n-benzoyl,benzoylhydroxamic acid,n-hydroxy-benzamide,benzenecarbohydroxamic acid PubChem CID: 10313 IUPAC Name: N-hydroxybenzamide SMILES: C1=CC=C(C=C1)C(=O)NO
PubChem CID | 10313 |
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CAS | 495-18-1 |
Molecular Weight (g/mol) | 137.138 |
MDL Number | MFCD00002109 |
SMILES | C1=CC=C(C=C1)C(=O)NO |
Synonym | benzohydroxamic acid,benzhydroxamic acid,benzamide, n-hydroxy,benzohydroxamate,phenylhydroxamic acid,benzohyroxamate,hydroxylamine, n-benzoyl,benzoylhydroxamic acid,n-hydroxy-benzamide,benzenecarbohydroxamic acid |
IUPAC Name | N-hydroxybenzamide |
InChI Key | VDEUYMSGMPQMIK-UHFFFAOYSA-N |
Molecular Formula | C7H7NO2 |
CAS | 3891-07-4 |
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MDL Number | MFCD00005903 |
Isopropyl Palmitate, NF, 90%, Spectrum™ Chemical
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CAS: 142-91-6 Molecular Formula: C19H38O2 Molecular Weight (g/mol): 298.51 MDL Number: MFCD00008993 InChI Key: XUGNVMKQXJXZCD-UHFFFAOYSA-N IUPAC Name: propan-2-yl hexadecanoate SMILES: CCCCCCCCCCCCCCCC(=O)OC(C)C
CAS | 142-91-6 |
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Molecular Weight (g/mol) | 298.51 |
MDL Number | MFCD00008993 |
SMILES | CCCCCCCCCCCCCCCC(=O)OC(C)C |
IUPAC Name | propan-2-yl hexadecanoate |
InChI Key | XUGNVMKQXJXZCD-UHFFFAOYSA-N |
Molecular Formula | C19H38O2 |
Sodium Valproate, EP, 98.5-101%, Spectrum™ Chemical
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CAS: 1069-66-5 Molecular Formula: C8H15NaO2 Molecular Weight (g/mol): 166.20 InChI Key: AEQFSUDEHCCHBT-UHFFFAOYSA-M IUPAC Name: sodium 2-propylpentanoate SMILES: [Na+].CCCC(CCC)C([O-])=O
CAS | 1069-66-5 |
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Molecular Weight (g/mol) | 166.20 |
SMILES | [Na+].CCCC(CCC)C([O-])=O |
IUPAC Name | sodium 2-propylpentanoate |
InChI Key | AEQFSUDEHCCHBT-UHFFFAOYSA-M |
Molecular Formula | C8H15NaO2 |