Carboxylic acids and derivatives
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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 |
n-Butyl butyrate, 99%
CAS: 109-21-7 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.21 MDL Number: MFCD00009450 InChI Key: XUPYJHCZDLZNFP-UHFFFAOYSA-N Synonym: butyl butyrate,n-butyl butyrate,butanoic acid, butyl ester,n-butyl butanoate,1-butyl butyrate,butyl butylate,butyric acid butyl ester,n-butyl n-butyrate,butyric acid, butyl ester,butyl n-butyrate PubChem CID: 7983 ChEBI: CHEBI:87429 IUPAC Name: butyl butanoate SMILES: CCCCOC(=O)CCC
| PubChem CID | 7983 |
|---|---|
| CAS | 109-21-7 |
| Molecular Weight (g/mol) | 144.21 |
| ChEBI | CHEBI:87429 |
| MDL Number | MFCD00009450 |
| SMILES | CCCCOC(=O)CCC |
| Synonym | butyl butyrate,n-butyl butyrate,butanoic acid, butyl ester,n-butyl butanoate,1-butyl butyrate,butyl butylate,butyric acid butyl ester,n-butyl n-butyrate,butyric acid, butyl ester,butyl n-butyrate |
| IUPAC Name | butyl butanoate |
| InChI Key | XUPYJHCZDLZNFP-UHFFFAOYSA-N |
| Molecular Formula | C8H16O2 |
Gallic acid ethyl ester, 99%
CAS: 831-61-8 Molecular Formula: C9H10O5 Molecular Weight (g/mol): 198.174 MDL Number: MFCD00016430 InChI Key: VFPFQHQNJCMNBZ-UHFFFAOYSA-N Synonym: ethyl gallate,gallic acid ethyl ester,phyllemblin,nipagallin a,progallin a,ethylgallate,nipa no. 48,gallic acid, ethyl ester,benzoic acid, 3,4,5-trihydroxy-, ethyl ester,nipa 48 PubChem CID: 13250 ChEBI: CHEBI:87247 IUPAC Name: ethyl 3,4,5-trihydroxybenzoate SMILES: CCOC(=O)C1=CC(=C(C(=C1)O)O)O
| PubChem CID | 13250 |
|---|---|
| CAS | 831-61-8 |
| Molecular Weight (g/mol) | 198.174 |
| ChEBI | CHEBI:87247 |
| MDL Number | MFCD00016430 |
| SMILES | CCOC(=O)C1=CC(=C(C(=C1)O)O)O |
| Synonym | ethyl gallate,gallic acid ethyl ester,phyllemblin,nipagallin a,progallin a,ethylgallate,nipa no. 48,gallic acid, ethyl ester,benzoic acid, 3,4,5-trihydroxy-, ethyl ester,nipa 48 |
| IUPAC Name | ethyl 3,4,5-trihydroxybenzoate |
| InChI Key | VFPFQHQNJCMNBZ-UHFFFAOYSA-N |
| Molecular Formula | C9H10O5 |
| CAS | 5466-06-8 |
|---|---|
| IUPAC Name | ethyl 3-sulfanylpropanoate |
o-Tolylacetic acid, 99%
CAS: 644-36-0 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00004328 InChI Key: RZWGTXHSYZGXKF-UHFFFAOYSA-N Synonym: o-tolylacetic acid,2-methylphenylacetic acid,2-methylphenyl acetic acid,2-2-methylphenyl acetic acid,2-o-tolyl acetic acid,2-tolylacetic acid,2-o-tolylacetic acid,o-methylphenylacetic acid,o-tolyacetic acid PubChem CID: 69519 IUPAC Name: 2-(2-methylphenyl)acetic acid SMILES: CC1=CC=CC=C1CC(=O)O
| PubChem CID | 69519 |
|---|---|
| CAS | 644-36-0 |
| Molecular Weight (g/mol) | 150.177 |
| MDL Number | MFCD00004328 |
| SMILES | CC1=CC=CC=C1CC(=O)O |
| Synonym | o-tolylacetic acid,2-methylphenylacetic acid,2-methylphenyl acetic acid,2-2-methylphenyl acetic acid,2-o-tolyl acetic acid,2-tolylacetic acid,2-o-tolylacetic acid,o-methylphenylacetic acid,o-tolyacetic acid |
| IUPAC Name | 2-(2-methylphenyl)acetic acid |
| InChI Key | RZWGTXHSYZGXKF-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
n-Butyl acetate, 99.5+%, for electronic use (MOS), residue free
CAS: 123-86-4 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00009445 InChI Key: DKPFZGUDAPQIHT-UHFFFAOYSA-N Synonym: n-butyl acetate,acetic acid, butyl ester,1-butyl acetate,butyl ethanoate,acetic acid butyl ester,n-butyl ethanoate,n-butylacetate,butylacetat,acetic acid n-butyl ester,acetate de butyle PubChem CID: 31272 ChEBI: CHEBI:31328 IUPAC Name: butyl acetate SMILES: CCCCOC(C)=O
| PubChem CID | 31272 |
|---|---|
| CAS | 123-86-4 |
| Molecular Weight (g/mol) | 116.16 |
| ChEBI | CHEBI:31328 |
| MDL Number | MFCD00009445 |
| SMILES | CCCCOC(C)=O |
| Synonym | n-butyl acetate,acetic acid, butyl ester,1-butyl acetate,butyl ethanoate,acetic acid butyl ester,n-butyl ethanoate,n-butylacetate,butylacetat,acetic acid n-butyl ester,acetate de butyle |
| IUPAC Name | butyl acetate |
| InChI Key | DKPFZGUDAPQIHT-UHFFFAOYSA-N |
| Molecular Formula | C6H12O2 |
3-(4-Carboxyphenyl)propionic acid, 98%
CAS: 38628-51-2 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.19 MDL Number: MFCD00016560 InChI Key: QSPCOYVUYYFWAU-UHFFFAOYSA-N Synonym: 4-2-carboxyethyl benzoic acid,3-4-carboxyphenyl propionic acid,3-4-carboxyphenyl propanoic acid,benzenepropanoic acid, 4-carboxy,pubchem19268,acmc-1ctf7,4-carboxyhydrocinnamic acid,4-carboxybenzenepropionic acid,4-2-carboxyethyl benzoicacid,carboxyphenylpropionicacid; 985 PubChem CID: 854054 IUPAC Name: 4-(2-carboxyethyl)benzoic acid SMILES: OC(=O)CCC1=CC=C(C=C1)C(O)=O
| PubChem CID | 854054 |
|---|---|
| CAS | 38628-51-2 |
| Molecular Weight (g/mol) | 194.19 |
| MDL Number | MFCD00016560 |
| SMILES | OC(=O)CCC1=CC=C(C=C1)C(O)=O |
| Synonym | 4-2-carboxyethyl benzoic acid,3-4-carboxyphenyl propionic acid,3-4-carboxyphenyl propanoic acid,benzenepropanoic acid, 4-carboxy,pubchem19268,acmc-1ctf7,4-carboxyhydrocinnamic acid,4-carboxybenzenepropionic acid,4-2-carboxyethyl benzoicacid,carboxyphenylpropionicacid; 985 |
| IUPAC Name | 4-(2-carboxyethyl)benzoic acid |
| InChI Key | QSPCOYVUYYFWAU-UHFFFAOYSA-N |
| Molecular Formula | C10H10O4 |
Edetate Disodium, USP, EP, JP, bioCERTIFIED™, 1 kg, Spectrum Chemical
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Bicyclo[2.2.2]oct-7-ene-2,3,5,6-tetracarboxylic dianhydride, 97%
CAS: 1719-83-1 Molecular Formula: C12H8O6 Molecular Weight (g/mol): 248.19 MDL Number: MFCD00082228 InChI Key: XLOGCGOPKPCECW-UHFFFAOYSA-N Synonym: bicyclo 2.2.2 oct-7-ene-2,3,5,6-tetracarboxylic dianhydride,4,4a,8,8a-tetrahydro-4,8-ethenobenzo 1,2-c:4,5-c' difuran-1,3,5,7 3ah,7ah-tetraone,bicyclo 2.2.2 oct-7-ene-2,3,5,6-tetracarboxylic acid dianhydride,4,8-etheno-1h,3h-benzo 1,2-c:4,5-c' difuran-1,3,5,7-tetrone, 3a,4,4a,7a,8,8a-hexahydro,bicyclo 2.2.2-7-octene-2,3,5,6-tetracarboxylic dianhydride,bicyclo 2.2.2-7-octene-2,3,5,6-tetracarboxylic acid dianhydride,4,10-dioxatetracyclo 5.5.2.0<2,6>.0<8,12> tetradec-13-ene-3,5,9,11-tetraone,4,10-dioxatetracyclo 5.5.2.0 2 ,?.0?, 1 2 tetradec-13-ene-3,5,9,11-tetrone,bicyclo 2.2.2 oct-7-ene-2,3:5,6-tetracarboxylic dianhydride,4,4a,8,8a-tetrahydro-4,8-ethenobenzo 1,2-c PubChem CID: 102679 SMILES: C1=CC2C3C(C1C4C2C(=O)OC4=O)C(=O)OC3=O
| PubChem CID | 102679 |
|---|---|
| CAS | 1719-83-1 |
| Molecular Weight (g/mol) | 248.19 |
| MDL Number | MFCD00082228 |
| SMILES | C1=CC2C3C(C1C4C2C(=O)OC4=O)C(=O)OC3=O |
| Synonym | bicyclo 2.2.2 oct-7-ene-2,3,5,6-tetracarboxylic dianhydride,4,4a,8,8a-tetrahydro-4,8-ethenobenzo 1,2-c:4,5-c' difuran-1,3,5,7 3ah,7ah-tetraone,bicyclo 2.2.2 oct-7-ene-2,3,5,6-tetracarboxylic acid dianhydride,4,8-etheno-1h,3h-benzo 1,2-c:4,5-c' difuran-1,3,5,7-tetrone, 3a,4,4a,7a,8,8a-hexahydro,bicyclo 2.2.2-7-octene-2,3,5,6-tetracarboxylic dianhydride,bicyclo 2.2.2-7-octene-2,3,5,6-tetracarboxylic acid dianhydride,4,10-dioxatetracyclo 5.5.2.0<2,6>.0<8,12> tetradec-13-ene-3,5,9,11-tetraone,4,10-dioxatetracyclo 5.5.2.0 2 ,?.0?, 1 2 tetradec-13-ene-3,5,9,11-tetrone,bicyclo 2.2.2 oct-7-ene-2,3:5,6-tetracarboxylic dianhydride,4,4a,8,8a-tetrahydro-4,8-ethenobenzo 1,2-c |
| InChI Key | XLOGCGOPKPCECW-UHFFFAOYSA-N |
| Molecular Formula | C12H8O6 |
Ethylenediamine Tetraacetic Acid Disodium Salt ACS MP Biomedicals
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 |
Mannose triflate, 98%
CAS: 92051-23-5 Molecular Formula: C15H19F3O12S Molecular Weight (g/mol): 480.36 InChI Key: OIBDVHSTOUGZTJ-PEBLQZBPSA-N Synonym: tatm,mannose triflate,1,3,4,6-tetra-o-acetyl-2-o-trifluoromethanesulfonyl-beta-d-mannopyranose,1,3,4,6-tetra-o-acetyl-2-o-trifluoromethanesulfonyl-b-d-mannopyranose,unii-0ki8ffq6tt,0ki8ffq6tt,beta-d-mannopyranose 1,3,4,6-tetra-o-acetate 2-o-trifluoromethanesulfonate,2r,3r,4s,5s,6s-3,4,6-tris acetyloxy-5-trifluoromethanesulfonyloxy oxan-2-yl methyl acetate,mannose trilfate PubChem CID: 11113597 IUPAC Name: [(2R,3R,4S,5S,6S)-3,4,6-triacetyloxy-5-(trifluoromethylsulfonyloxy)oxan-2-yl]methyl acetate SMILES: CC(=O)OCC1C(C(C(C(O1)OC(=O)C)OS(=O)(=O)C(F)(F)F)OC(=O)C)OC(=O)C
| PubChem CID | 11113597 |
|---|---|
| CAS | 92051-23-5 |
| Molecular Weight (g/mol) | 480.36 |
| SMILES | CC(=O)OCC1C(C(C(C(O1)OC(=O)C)OS(=O)(=O)C(F)(F)F)OC(=O)C)OC(=O)C |
| Synonym | tatm,mannose triflate,1,3,4,6-tetra-o-acetyl-2-o-trifluoromethanesulfonyl-beta-d-mannopyranose,1,3,4,6-tetra-o-acetyl-2-o-trifluoromethanesulfonyl-b-d-mannopyranose,unii-0ki8ffq6tt,0ki8ffq6tt,beta-d-mannopyranose 1,3,4,6-tetra-o-acetate 2-o-trifluoromethanesulfonate,2r,3r,4s,5s,6s-3,4,6-tris acetyloxy-5-trifluoromethanesulfonyloxy oxan-2-yl methyl acetate,mannose trilfate |
| IUPAC Name | [(2R,3R,4S,5S,6S)-3,4,6-triacetyloxy-5-(trifluoromethylsulfonyloxy)oxan-2-yl]methyl acetate |
| InChI Key | OIBDVHSTOUGZTJ-PEBLQZBPSA-N |
| Molecular Formula | C15H19F3O12S |
Edetate Disodium, Multi-Compendial, U.S.P., J.T. Baker™
CAS: 6381-92-6 Molecular Formula: C10H18N2Na2O10 Molecular Weight (g/mol): 372.24 MDL Number: MFCD00150037 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 |
| 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 |
Edetate Disodium, Dihydrate, USP, 99-101%, Spectrum™ Chemical
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CAS: 6381-92-6 Molecular Formula: C10H18N2Na2O10 Molecular Weight (g/mol): 372.24 MDL Number: MFCD00150037,MFCD00003541 InChI Key: OVBJJZOQPCKUOR-UHFFFAOYSA-L 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
| 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 |
| IUPAC Name | disodium 2-({2-[(carboxylatomethyl)(carboxymethyl)amino]ethyl}(carboxymethyl)amino)acetate dihydrate |
| InChI Key | OVBJJZOQPCKUOR-UHFFFAOYSA-L |
| Molecular Formula | C10H18N2Na2O10 |
EDTA, Powder, BAKER ANALYZED™ A.C.S. Reagent, J.T. Baker™
CAS: 60-00-4 Molecular Formula: C10H16N2O8 Molecular Weight (g/mol): 292.24 MDL Number: MFCD00003541 InChI Key: KCXVZYZYPLLWCC-UHFFFAOYSA-N Synonym: edta,edetic acid,ethylenediaminetetraacetic acid,edathamil,versene,endrate,havidote,titriplex,edta acid,sequestrol PubChem CID: 6049 ChEBI: CHEBI:42191 IUPAC Name: 2-({2-[bis(carboxymethyl)amino]ethyl}(carboxymethyl)amino)acetic acid SMILES: OC(=O)CN(CCN(CC(O)=O)CC(O)=O)CC(O)=O
| PubChem CID | 6049 |
|---|---|
| CAS | 60-00-4 |
| Molecular Weight (g/mol) | 292.24 |
| ChEBI | CHEBI:42191 |
| MDL Number | MFCD00003541 |
| SMILES | OC(=O)CN(CCN(CC(O)=O)CC(O)=O)CC(O)=O |
| Synonym | edta,edetic acid,ethylenediaminetetraacetic acid,edathamil,versene,endrate,havidote,titriplex,edta acid,sequestrol |
| IUPAC Name | 2-({2-[bis(carboxymethyl)amino]ethyl}(carboxymethyl)amino)acetic acid |
| InChI Key | KCXVZYZYPLLWCC-UHFFFAOYSA-N |
| Molecular Formula | C10H16N2O8 |
Thermo Scientific Chemicals 1,2,3,4-Tetra-O-acetyl-beta-D-glucopyranose, 98%
CAS: 13100-46-4 Molecular Formula: C14H20O10 Molecular Weight (g/mol): 348.30 MDL Number: MFCD00063260 InChI Key: FEQXFAYSNRWXDW-UHFFFAOYNA-N Synonym: 1,2,3,4-tetra-o-acetyl-beta-d-glucopyranose,beta-d-glucose 1,2,3,4-tetraacetate,2s,3r,4s,5r,6r-6-hydroxymethyl tetrahydro-2h-pyran-2,3,4,5-tetrayl tetraacetate,2r,3r,4s,5r,6s-4,5,6-tris acetyloxy-2-hydroxymethyl oxan-3-yl acetate,1,2,3,4-tetra-o-acetylglucopyranose,beta-d-glucopyranose 1,2,3,4-tetraacetate,1,2,3,4-tetra-o-acetyl-b-d-glucopyranose,beta-d-glucopyranose, 1,2,3,4-tetraacetate,b-d-glucopyranose,1,2,3,4-tetraacetate PubChem CID: 83136 IUPAC Name: [(2R,3R,4S,5R,6S)-4,5,6-triacetyloxy-2-(hydroxymethyl)oxan-3-yl] acetate SMILES: CC(=O)OC1OC(CO)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O
| PubChem CID | 83136 |
|---|---|
| CAS | 13100-46-4 |
| Molecular Weight (g/mol) | 348.30 |
| MDL Number | MFCD00063260 |
| SMILES | CC(=O)OC1OC(CO)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O |
| Synonym | 1,2,3,4-tetra-o-acetyl-beta-d-glucopyranose,beta-d-glucose 1,2,3,4-tetraacetate,2s,3r,4s,5r,6r-6-hydroxymethyl tetrahydro-2h-pyran-2,3,4,5-tetrayl tetraacetate,2r,3r,4s,5r,6s-4,5,6-tris acetyloxy-2-hydroxymethyl oxan-3-yl acetate,1,2,3,4-tetra-o-acetylglucopyranose,beta-d-glucopyranose 1,2,3,4-tetraacetate,1,2,3,4-tetra-o-acetyl-b-d-glucopyranose,beta-d-glucopyranose, 1,2,3,4-tetraacetate,b-d-glucopyranose,1,2,3,4-tetraacetate |
| IUPAC Name | [(2R,3R,4S,5R,6S)-4,5,6-triacetyloxy-2-(hydroxymethyl)oxan-3-yl] acetate |
| InChI Key | FEQXFAYSNRWXDW-UHFFFAOYNA-N |
| Molecular Formula | C14H20O10 |