Carboxylic acids and derivatives
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N-tert-Butylacetamide, 98%
CAS: 762-84-5 Molecular Formula: C6H13NO Molecular Weight (g/mol): 115.176 MDL Number: MFCD00038244 InChI Key: ACYFWRHALJTSCF-UHFFFAOYSA-N Synonym: n-tert-butyl acetamide,tert-butylacetamide,n-t-butylacetamide,acetamide, n-1,1-dimethylethyl,ch3c o nhc ch3 3,acetamide,n-1,1-dimethylethyl PubChem CID: 12985 IUPAC Name: N-tert-butylacetamide SMILES: CC(=O)NC(C)(C)C
| PubChem CID | 12985 |
|---|---|
| CAS | 762-84-5 |
| Molecular Weight (g/mol) | 115.176 |
| MDL Number | MFCD00038244 |
| SMILES | CC(=O)NC(C)(C)C |
| Synonym | n-tert-butyl acetamide,tert-butylacetamide,n-t-butylacetamide,acetamide, n-1,1-dimethylethyl,ch3c o nhc ch3 3,acetamide,n-1,1-dimethylethyl |
| IUPAC Name | N-tert-butylacetamide |
| InChI Key | ACYFWRHALJTSCF-UHFFFAOYSA-N |
| Molecular Formula | C6H13NO |
trans-3-(4-Pyridyl)acrylic acid, 97%
CAS: 84228-93-3 Molecular Formula: C8H7NO2 Molecular Weight (g/mol): 149.149 MDL Number: MFCD00040746 InChI Key: SSAYTINUCCRGDR-OWOJBTEDSA-N Synonym: 3-4-pyridyl acrylic acid,trans-3-4-pyridyl acrylic acid,3-pyridin-4-yl-acrylic acid,4-pyridineacrylic acid,e-3-pyridin-4-yl acrylic acid,3-pyridin-4-yl acrylic acid,2e-3-pyridin-4-ylacrylic acid,3-4-pyridine acrylic acid,2e-3-pyridin-4-yl prop-2-enoic acid,e-3-pyridin-4-yl-acrylic acid PubChem CID: 736782 IUPAC Name: (E)-3-pyridin-4-ylprop-2-enoic acid SMILES: C1=CN=CC=C1C=CC(=O)O
| PubChem CID | 736782 |
|---|---|
| CAS | 84228-93-3 |
| Molecular Weight (g/mol) | 149.149 |
| MDL Number | MFCD00040746 |
| SMILES | C1=CN=CC=C1C=CC(=O)O |
| Synonym | 3-4-pyridyl acrylic acid,trans-3-4-pyridyl acrylic acid,3-pyridin-4-yl-acrylic acid,4-pyridineacrylic acid,e-3-pyridin-4-yl acrylic acid,3-pyridin-4-yl acrylic acid,2e-3-pyridin-4-ylacrylic acid,3-4-pyridine acrylic acid,2e-3-pyridin-4-yl prop-2-enoic acid,e-3-pyridin-4-yl-acrylic acid |
| IUPAC Name | (E)-3-pyridin-4-ylprop-2-enoic acid |
| InChI Key | SSAYTINUCCRGDR-OWOJBTEDSA-N |
| Molecular Formula | C8H7NO2 |
Methyl 2-(bromomethyl)acrylate, 96%
CAS: 4224-69-5 Molecular Formula: C5H7BrO2 Molecular Weight (g/mol): 179.01 MDL Number: MFCD00011697 InChI Key: CFTUQSLVERGMHL-UHFFFAOYSA-N Synonym: methyl 2-bromomethyl acrylate,methyl 2-bromomethyl prop-2-enoate,methyl 2-bromomethyl-2-propenoate,methyl alpha-bromomethyl acrylate,2-bromomethyl methyl acrylate,2-propenoic acid, 2-bromomethyl-, methyl ester,2-bromomethyl acrylic acid methyl ester,acrylic acid, 2-bromomethyl-, methyl ester,zlchem 195,pubchem17371 PubChem CID: 521093 IUPAC Name: methyl 2-(bromomethyl)prop-2-enoate SMILES: COC(=O)C(=C)CBr
| PubChem CID | 521093 |
|---|---|
| CAS | 4224-69-5 |
| Molecular Weight (g/mol) | 179.01 |
| MDL Number | MFCD00011697 |
| SMILES | COC(=O)C(=C)CBr |
| Synonym | methyl 2-bromomethyl acrylate,methyl 2-bromomethyl prop-2-enoate,methyl 2-bromomethyl-2-propenoate,methyl alpha-bromomethyl acrylate,2-bromomethyl methyl acrylate,2-propenoic acid, 2-bromomethyl-, methyl ester,2-bromomethyl acrylic acid methyl ester,acrylic acid, 2-bromomethyl-, methyl ester,zlchem 195,pubchem17371 |
| IUPAC Name | methyl 2-(bromomethyl)prop-2-enoate |
| InChI Key | CFTUQSLVERGMHL-UHFFFAOYSA-N |
| Molecular Formula | C5H7BrO2 |
Thioglycolic Acid Solution, ∼80 in Water, MilliporeSigma™ Supelco™
MDL Number: MFCD00004876 Synonym: Mercaptoacetic acid
| MDL Number | MFCD00004876 |
|---|---|
| Synonym | Mercaptoacetic acid |
n-Butyl Acetate, ACS, 99.5%, Spectrum™ Chemical
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CAS: 123-86-4 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 InChI Key: DKPFZGUDAPQIHT-UHFFFAOYSA-N IUPAC Name: butyl acetate SMILES: CCCCOC(C)=O
| CAS | 123-86-4 |
|---|---|
| Molecular Weight (g/mol) | 116.16 |
| SMILES | CCCCOC(C)=O |
| IUPAC Name | butyl acetate |
| InChI Key | DKPFZGUDAPQIHT-UHFFFAOYSA-N |
| Molecular Formula | C6H12O2 |
Methyl thiophene-3-carboxylate, 97%, Thermo Scientific Chemicals
CAS: 22913-26-4 Molecular Formula: C6H6O2S Molecular Weight (g/mol): 142.17 MDL Number: MFCD06203810 InChI Key: ZTRAEMILTFNZSM-UHFFFAOYSA-N Synonym: methyl 3-thiophenecarboxylate,3-thiophenecarboxylic acid, methyl ester,thiophene-3-carboxylic acid methyl ester,3-thiophenecarboxylicacid, methyl ester,methyl thiophen-3-carboxylate,methyl-3-thenoate,methyl 3-thenoate,3-methoxycarbonylthiophene,3-methoxy carbonyl-thiophene,methyl 3-thiophenecarboxylate # PubChem CID: 574151 IUPAC Name: methyl thiophene-3-carboxylate SMILES: COC(=O)C1=CSC=C1
| PubChem CID | 574151 |
|---|---|
| CAS | 22913-26-4 |
| Molecular Weight (g/mol) | 142.17 |
| MDL Number | MFCD06203810 |
| SMILES | COC(=O)C1=CSC=C1 |
| Synonym | methyl 3-thiophenecarboxylate,3-thiophenecarboxylic acid, methyl ester,thiophene-3-carboxylic acid methyl ester,3-thiophenecarboxylicacid, methyl ester,methyl thiophen-3-carboxylate,methyl-3-thenoate,methyl 3-thenoate,3-methoxycarbonylthiophene,3-methoxy carbonyl-thiophene,methyl 3-thiophenecarboxylate # |
| IUPAC Name | methyl thiophene-3-carboxylate |
| InChI Key | ZTRAEMILTFNZSM-UHFFFAOYSA-N |
| Molecular Formula | C6H6O2S |
5-Methyl-2-phenyl-2H-1,2,3-triazole-4-carboxylic acid, 97%, Thermo Scientific™
CAS: 22300-56-7 Molecular Formula: C10H9N3O2 Molecular Weight (g/mol): 203.201 MDL Number: MFCD00051653 InChI Key: GQYQHAGPALBYDO-UHFFFAOYSA-N Synonym: 5-methyl-2-phenyl-2h-1,2,3-triazole-4-carboxylic acid,4-methyl-2-phenyl-1,2,3-triazole-5-carboxylic acid,5-methyl-2-phenyl-1,2,3-triazole-4-carboxylic acid,4-methyl-2-phenyl-2h-1,2,3-triazole-5-carboxylic acid,2h-1,2,3-triazole-4-carboxylic acid, 5-methyl-2-phenyl,acmc-20ame3,maybridge1_002457,4-carboxy-5-methyl-2-phenyl-1,2,3-triazole,2-phenyl-5-methyl-4-carboxy-2h-1,2,3-triazole,2h-1,2,3-triazole-4-carboxylicacid,5-methyl-2-phenyl PubChem CID: 519936 IUPAC Name: 5-methyl-2-phenyltriazole-4-carboxylic acid SMILES: CC1=NN(N=C1C(=O)O)C2=CC=CC=C2
| PubChem CID | 519936 |
|---|---|
| CAS | 22300-56-7 |
| Molecular Weight (g/mol) | 203.201 |
| MDL Number | MFCD00051653 |
| SMILES | CC1=NN(N=C1C(=O)O)C2=CC=CC=C2 |
| Synonym | 5-methyl-2-phenyl-2h-1,2,3-triazole-4-carboxylic acid,4-methyl-2-phenyl-1,2,3-triazole-5-carboxylic acid,5-methyl-2-phenyl-1,2,3-triazole-4-carboxylic acid,4-methyl-2-phenyl-2h-1,2,3-triazole-5-carboxylic acid,2h-1,2,3-triazole-4-carboxylic acid, 5-methyl-2-phenyl,acmc-20ame3,maybridge1_002457,4-carboxy-5-methyl-2-phenyl-1,2,3-triazole,2-phenyl-5-methyl-4-carboxy-2h-1,2,3-triazole,2h-1,2,3-triazole-4-carboxylicacid,5-methyl-2-phenyl |
| IUPAC Name | 5-methyl-2-phenyltriazole-4-carboxylic acid |
| InChI Key | GQYQHAGPALBYDO-UHFFFAOYSA-N |
| Molecular Formula | C10H9N3O2 |
Ethylenediaminetetraacetic Acid Magnesium Disodium Salt, Spectrum™ Chemical
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CAS: 14402-88-1
| CAS | 14402-88-1 |
|---|
MilliporeSigma™ EDTA, Disodium Salt, Dihydrate, OmniPur™, Calbiochem™,
CAS: 6381-92-6 Molecular Formula: C10H18N2Na2O10 Molecular Weight (g/mol): 372.24 MDL Number: MFCD00150037,MFCD00003541 InChI Key: OVBJJZOQPCKUOR-UHFFFAOYSA-L Synonym: edta disodium salt,cal-ex decalcifier,buffer solution, ph 10.00,sodium di ethylenediamine tetraacetate dihydrate,ethylenediamine tetraacetic acid, disodium salt dihydrate,ethylenediamine tetraacetic acid, disodium salt, standard solution,sodium di ethylenediamine tetraacetate standard solution,ethylenedinitrilo tetraacetic acid disodium, dihydrate, reagent, acs PubChem CID: 44120005 IUPAC Name: disodium 2-({2-[(carboxylatomethyl)(carboxymethyl)amino]ethyl}(carboxymethyl)amino)acetate dihydrate SMILES: O.O.[Na+].[Na+].OC(=O)CN(CCN(CC(O)=O)CC([O-])=O)CC([O-])=O
| PubChem CID | 44120005 |
|---|---|
| CAS | 6381-92-6 |
| Molecular Weight (g/mol) | 372.24 |
| MDL Number | MFCD00150037,MFCD00003541 |
| SMILES | O.O.[Na+].[Na+].OC(=O)CN(CCN(CC(O)=O)CC([O-])=O)CC([O-])=O |
| Synonym | edta disodium salt,cal-ex decalcifier,buffer solution, ph 10.00,sodium di ethylenediamine tetraacetate dihydrate,ethylenediamine tetraacetic acid, disodium salt dihydrate,ethylenediamine tetraacetic acid, disodium salt, standard solution,sodium di ethylenediamine tetraacetate standard solution,ethylenedinitrilo tetraacetic acid disodium, dihydrate, reagent, acs |
| IUPAC Name | disodium 2-({2-[(carboxylatomethyl)(carboxymethyl)amino]ethyl}(carboxymethyl)amino)acetate dihydrate |
| InChI Key | OVBJJZOQPCKUOR-UHFFFAOYSA-L |
| Molecular Formula | C10H18N2Na2O10 |
3-Methyl-1H-pyrazole-5-carboxylic acid, 97%
CAS: 402-61-9 Molecular Formula: C5H6N2O2 Molecular Weight (g/mol): 126.115 MDL Number: MFCD00462235 InChI Key: WSMQKESQZFQMFW-UHFFFAOYSA-N Synonym: 3-methyl-1h-pyrazole-5-carboxylic acid,5-methylpyrazole-3-carboxylic acid,5-methyl-2h-pyrazole-3-carboxylic acid,3-methylpyrazole-5-carboxylic acid,1h-pyrazole-3-carboxylicacid, 5-methyl,5-methylpyrazole-3-carboxylicacid,3-methyl-1h-pyrazole-5-carboxylicacid,pyrazole-3-carboxylic acid, 5-methyl,pubchem7842,5-methyl-2h-pyrazole-3-carboxylicacid PubChem CID: 9822 ChEBI: CHEBI:74739 IUPAC Name: 5-methyl-1H-pyrazole-3-carboxylic acid SMILES: CC1=CC(=NN1)C(=O)O
| PubChem CID | 9822 |
|---|---|
| CAS | 402-61-9 |
| Molecular Weight (g/mol) | 126.115 |
| ChEBI | CHEBI:74739 |
| MDL Number | MFCD00462235 |
| SMILES | CC1=CC(=NN1)C(=O)O |
| Synonym | 3-methyl-1h-pyrazole-5-carboxylic acid,5-methylpyrazole-3-carboxylic acid,5-methyl-2h-pyrazole-3-carboxylic acid,3-methylpyrazole-5-carboxylic acid,1h-pyrazole-3-carboxylicacid, 5-methyl,5-methylpyrazole-3-carboxylicacid,3-methyl-1h-pyrazole-5-carboxylicacid,pyrazole-3-carboxylic acid, 5-methyl,pubchem7842,5-methyl-2h-pyrazole-3-carboxylicacid |
| IUPAC Name | 5-methyl-1H-pyrazole-3-carboxylic acid |
| InChI Key | WSMQKESQZFQMFW-UHFFFAOYSA-N |
| Molecular Formula | C5H6N2O2 |
Isopropyl Myristate, B&J Brand™, for sterility testing of ophthalmic ointments, Honeywell Burdick & Jackson
CAS: 110-27-0 Molecular Formula: C17H34O2 Molecular Weight (g/mol): 270.457 InChI Key: AXISYYRBXTVTFY-UHFFFAOYSA-N Synonym: isopropyl myristate,isopropyl tetradecanoate,estergel,bisomel,isomyst,promyr,tetradecanoic acid, 1-methylethyl ester,deltyl extra,kesscomir,tegester PubChem CID: 8042 IUPAC Name: propan-2-yl tetradecanoate SMILES: CCCCCCCCCCCCCC(=O)OC(C)C
| PubChem CID | 8042 |
|---|---|
| CAS | 110-27-0 |
| Molecular Weight (g/mol) | 270.457 |
| SMILES | CCCCCCCCCCCCCC(=O)OC(C)C |
| Synonym | isopropyl myristate,isopropyl tetradecanoate,estergel,bisomel,isomyst,promyr,tetradecanoic acid, 1-methylethyl ester,deltyl extra,kesscomir,tegester |
| IUPAC Name | propan-2-yl tetradecanoate |
| InChI Key | AXISYYRBXTVTFY-UHFFFAOYSA-N |
| Molecular Formula | C17H34O2 |
MilliporeSigma™ 2',7'-Dichlorofluorescin Diacetate, Calbiochem™,
CAS: 4091-99-0 Molecular Formula: C24H16Cl2O7 Molecular Weight (g/mol): 487.285 InChI Key: PXEZTIWVRVSYOK-UHFFFAOYSA-N Synonym: h2dcfda,2-3,6-diacetoxy-2,7-dichloro-9h-xanthen-9-yl benzoic acid,2',7'-dichlorohydrofluorescein diacetate,2,7-dichlorodihydrofluorescein diacetate,benzoic acid, 2-3,6-bis acetyloxy-2,7-dichloro-9h-xanthen-9-yl,2-3,6-bis acetyloxy-2,7-dichloro-9h-xanthen-9-yl benzoic acid,2′,7′-dichlorofluorescin diacetate,2′,7′-dichlorodihydrofluorescein diacetate,2-3,6-diacetyloxy-2,7-dichloro-9h-xanthen-9-yl benzoic acid PubChem CID: 77718 IUPAC Name: 2-(3,6-diacetyloxy-2,7-dichloro-9H-xanthen-9-yl)benzoic acid SMILES: CC(=O)OC1=C(C=C2C(C3=CC(=C(C=C3OC2=C1)OC(=O)C)Cl)C4=CC=CC=C4C(=O)O)Cl
| PubChem CID | 77718 |
|---|---|
| CAS | 4091-99-0 |
| Molecular Weight (g/mol) | 487.285 |
| SMILES | CC(=O)OC1=C(C=C2C(C3=CC(=C(C=C3OC2=C1)OC(=O)C)Cl)C4=CC=CC=C4C(=O)O)Cl |
| Synonym | h2dcfda,2-3,6-diacetoxy-2,7-dichloro-9h-xanthen-9-yl benzoic acid,2',7'-dichlorohydrofluorescein diacetate,2,7-dichlorodihydrofluorescein diacetate,benzoic acid, 2-3,6-bis acetyloxy-2,7-dichloro-9h-xanthen-9-yl,2-3,6-bis acetyloxy-2,7-dichloro-9h-xanthen-9-yl benzoic acid,2′,7′-dichlorofluorescin diacetate,2′,7′-dichlorodihydrofluorescein diacetate,2-3,6-diacetyloxy-2,7-dichloro-9h-xanthen-9-yl benzoic acid |
| IUPAC Name | 2-(3,6-diacetyloxy-2,7-dichloro-9H-xanthen-9-yl)benzoic acid |
| InChI Key | PXEZTIWVRVSYOK-UHFFFAOYSA-N |
| Molecular Formula | C24H16Cl2O7 |
Trimethylacetic acid, 99%
CAS: 75-98-9 Molecular Formula: C5H10O2 Molecular Weight (g/mol): 102.133 MDL Number: MFCD00004194 InChI Key: IUGYQRQAERSCNH-UHFFFAOYSA-N Synonym: pivalic acid,trimethylacetic acid,neopentanoic acid,2,2-dimethylpropionic acid,tert-pentanoic acid,propanoic acid, 2,2-dimethyl,versatic 5,kyselina pivalova,acetic acid, trimethyl,alpha,alpha-dimethylpropionic acid PubChem CID: 6417 ChEBI: CHEBI:45133 IUPAC Name: 2,2-dimethylpropanoic acid SMILES: CC(C)(C)C(=O)O
| PubChem CID | 6417 |
|---|---|
| CAS | 75-98-9 |
| Molecular Weight (g/mol) | 102.133 |
| ChEBI | CHEBI:45133 |
| MDL Number | MFCD00004194 |
| SMILES | CC(C)(C)C(=O)O |
| Synonym | pivalic acid,trimethylacetic acid,neopentanoic acid,2,2-dimethylpropionic acid,tert-pentanoic acid,propanoic acid, 2,2-dimethyl,versatic 5,kyselina pivalova,acetic acid, trimethyl,alpha,alpha-dimethylpropionic acid |
| IUPAC Name | 2,2-dimethylpropanoic acid |
| InChI Key | IUGYQRQAERSCNH-UHFFFAOYSA-N |
| Molecular Formula | C5H10O2 |
Methyl chloroacetate, 99+%
CAS: 96-34-4 Molecular Formula: C3H5ClO2 Molecular Weight (g/mol): 108.521 MDL Number: MFCD00000931 InChI Key: QABLOFMHHSOFRJ-UHFFFAOYSA-N Synonym: methyl chloroacetate,chloroacetic acid methyl ester,methyl monochloroacetate,methyl chloroethanoate,acetic acid, chloro-, methyl ester,methyl monochloracetate,methyl alpha-chloroacetate,methylchloroacetate,unii-450vsb182i,ccris 7749 PubChem CID: 7295 IUPAC Name: methyl 2-chloroacetate SMILES: COC(=O)CCl
| PubChem CID | 7295 |
|---|---|
| CAS | 96-34-4 |
| Molecular Weight (g/mol) | 108.521 |
| MDL Number | MFCD00000931 |
| SMILES | COC(=O)CCl |
| Synonym | methyl chloroacetate,chloroacetic acid methyl ester,methyl monochloroacetate,methyl chloroethanoate,acetic acid, chloro-, methyl ester,methyl monochloracetate,methyl alpha-chloroacetate,methylchloroacetate,unii-450vsb182i,ccris 7749 |
| IUPAC Name | methyl 2-chloroacetate |
| InChI Key | QABLOFMHHSOFRJ-UHFFFAOYSA-N |
| Molecular Formula | C3H5ClO2 |