Carboxylic acids and derivatives
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n-Butyl acetate, 99+%, Extra Dry, AcroSeal™
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 |
Manganese(II) oxalate dihydrate, Mn 30% min
CAS: 6556-16-7 Molecular Formula: C2H4MnO6 Molecular Weight (g/mol): 178.986 MDL Number: MFCD00150452 InChI Key: HDJUVFZHZGPHCQ-UHFFFAOYSA-L Synonym: manganese ii oxalate 2-hydrate PubChem CID: 131882857 IUPAC Name: manganese(2+);oxalate;dihydrate SMILES: C(=O)(C(=O)[O-])[O-].O.O.[Mn+2]
| PubChem CID | 131882857 |
|---|---|
| CAS | 6556-16-7 |
| Molecular Weight (g/mol) | 178.986 |
| MDL Number | MFCD00150452 |
| SMILES | C(=O)(C(=O)[O-])[O-].O.O.[Mn+2] |
| Synonym | manganese ii oxalate 2-hydrate |
| IUPAC Name | manganese(2+);oxalate;dihydrate |
| InChI Key | HDJUVFZHZGPHCQ-UHFFFAOYSA-L |
| Molecular Formula | C2H4MnO6 |
4-Acetamido-TEMPO, free radical, 98+%
CAS: 14691-89-5 Molecular Formula: C11H21N2O2 Molecular Weight (g/mol): 213.301 MDL Number: MFCD00043593 InChI Key: UXBLSWOMIHTQPH-UHFFFAOYSA-N Synonym: 4-acetamido-tempo,4-acetamido-2,2,6,6-tetramethylpiperidine 1-oxyl,4-acetamido-tempo, free radical,unii-g7abj73l6s,g7abj73l6s,4-acetylamino-2,2,6,6-tetramethylpiperidin-1-oxyl,pubchem9193,aa-tempo,4-acetamido-2,2,6,6-tetramethyl-1-piperidinyl oxidanyl PubChem CID: 518988 IUPAC Name: N-(1-$l^{1}-oxidanyl-2,2,6,6-tetramethylpiperidin-4-yl)acetamide SMILES: CC(=O)NC1CC(N(C(C1)(C)C)[O])(C)C
| PubChem CID | 518988 |
|---|---|
| CAS | 14691-89-5 |
| Molecular Weight (g/mol) | 213.301 |
| MDL Number | MFCD00043593 |
| SMILES | CC(=O)NC1CC(N(C(C1)(C)C)[O])(C)C |
| Synonym | 4-acetamido-tempo,4-acetamido-2,2,6,6-tetramethylpiperidine 1-oxyl,4-acetamido-tempo, free radical,unii-g7abj73l6s,g7abj73l6s,4-acetylamino-2,2,6,6-tetramethylpiperidin-1-oxyl,pubchem9193,aa-tempo,4-acetamido-2,2,6,6-tetramethyl-1-piperidinyl oxidanyl |
| IUPAC Name | N-(1-$l^{1}-oxidanyl-2,2,6,6-tetramethylpiperidin-4-yl)acetamide |
| InChI Key | UXBLSWOMIHTQPH-UHFFFAOYSA-N |
| Molecular Formula | C11H21N2O2 |
N-tert-Butylacrylamide, 97%
CAS: 107-58-4 Molecular Formula: C7H13NO Molecular Weight (g/mol): 127.19 MDL Number: MFCD00026271 InChI Key: XFHJDMUEHUHAJW-UHFFFAOYSA-N Synonym: n-tert-butylacrylamide,tert-butylacrylamide,n-tert-butyl acrylamide,2-propenamide, n-1,1-dimethylethyl,acrylamide, n-tert-butyl,n-t-butylacrylamide,unii-xj13fsh48k,n-1,1-dimethylethyl-2-propenamide,xj13fsh48k,n-tert-butyl prop-2-enamide PubChem CID: 7877 IUPAC Name: N-tert-butylprop-2-enamide SMILES: CC(C)(C)NC(=O)C=C
| PubChem CID | 7877 |
|---|---|
| CAS | 107-58-4 |
| Molecular Weight (g/mol) | 127.19 |
| MDL Number | MFCD00026271 |
| SMILES | CC(C)(C)NC(=O)C=C |
| Synonym | n-tert-butylacrylamide,tert-butylacrylamide,n-tert-butyl acrylamide,2-propenamide, n-1,1-dimethylethyl,acrylamide, n-tert-butyl,n-t-butylacrylamide,unii-xj13fsh48k,n-1,1-dimethylethyl-2-propenamide,xj13fsh48k,n-tert-butyl prop-2-enamide |
| IUPAC Name | N-tert-butylprop-2-enamide |
| InChI Key | XFHJDMUEHUHAJW-UHFFFAOYSA-N |
| Molecular Formula | C7H13NO |
meso-2,3-Dimercaptosuccinic acid, 97%
CAS: 304-55-2 Molecular Formula: C4H6O4S2 Molecular Weight (g/mol): 182.208 MDL Number: MFCD00064799 InChI Key: ACTRVOBWPAIOHC-XIXRPRMCSA-N Synonym: succimer,meso-2,3-dimercaptosuccinic acid,meso-dimercaptosuccinic acid,dmsa,dim-sa,2r,3s-rel-2,3-dimercaptosuccinic acid,succimero,succimerum,chemet,dimercaptosuccinic acid PubChem CID: 2724354 ChEBI: CHEBI:63623 IUPAC Name: (2S,3R)-2,3-bis(sulfanyl)butanedioic acid SMILES: C(C(C(=O)O)S)(C(=O)O)S
| PubChem CID | 2724354 |
|---|---|
| CAS | 304-55-2 |
| Molecular Weight (g/mol) | 182.208 |
| ChEBI | CHEBI:63623 |
| MDL Number | MFCD00064799 |
| SMILES | C(C(C(=O)O)S)(C(=O)O)S |
| Synonym | succimer,meso-2,3-dimercaptosuccinic acid,meso-dimercaptosuccinic acid,dmsa,dim-sa,2r,3s-rel-2,3-dimercaptosuccinic acid,succimero,succimerum,chemet,dimercaptosuccinic acid |
| IUPAC Name | (2S,3R)-2,3-bis(sulfanyl)butanedioic acid |
| InChI Key | ACTRVOBWPAIOHC-XIXRPRMCSA-N |
| Molecular Formula | C4H6O4S2 |
L-Lactic acid, anhydrous, 98%
CAS: 79-33-4 Molecular Formula: C3H6O3 Molecular Weight (g/mol): 90.078 MDL Number: MFCD00064266 InChI Key: JVTAAEKCZFNVCJ-REOHCLBHSA-N Synonym: l-lactic acid,l-+-lactic acid,s-2-hydroxypropanoic acid,s-lactic acid,sarcolactic acid,s-2-hydroxypropionic acid,2s-2-hydroxypropanoic acid,+-lactic acid,espiritin,tisulac PubChem CID: 107689 ChEBI: CHEBI:422 IUPAC Name: (2S)-2-hydroxypropanoic acid SMILES: CC(C(=O)O)O
| PubChem CID | 107689 |
|---|---|
| CAS | 79-33-4 |
| Molecular Weight (g/mol) | 90.078 |
| ChEBI | CHEBI:422 |
| MDL Number | MFCD00064266 |
| SMILES | CC(C(=O)O)O |
| Synonym | l-lactic acid,l-+-lactic acid,s-2-hydroxypropanoic acid,s-lactic acid,sarcolactic acid,s-2-hydroxypropionic acid,2s-2-hydroxypropanoic acid,+-lactic acid,espiritin,tisulac |
| IUPAC Name | (2S)-2-hydroxypropanoic acid |
| InChI Key | JVTAAEKCZFNVCJ-REOHCLBHSA-N |
| Molecular Formula | C3H6O3 |
Ethyl propionate, 99%
CAS: 105-37-3 Molecular Formula: C5H10O2 Molecular Weight (g/mol): 102.133 MDL Number: MFCD00009308 InChI Key: FKRCODPIKNYEAC-UHFFFAOYSA-N Synonym: ethyl propionate,propanoic acid, ethyl ester,propionic ester,propionic ether,propionic acid, ethyl ester,ethylpropionate,propionate d'ethyle,propanoic acid ethyl ester,ethyl n-propionate,propionic acid ethyl ester PubChem CID: 7749 ChEBI: CHEBI:41330 IUPAC Name: ethyl propanoate SMILES: CCC(=O)OCC
| PubChem CID | 7749 |
|---|---|
| CAS | 105-37-3 |
| Molecular Weight (g/mol) | 102.133 |
| ChEBI | CHEBI:41330 |
| MDL Number | MFCD00009308 |
| SMILES | CCC(=O)OCC |
| Synonym | ethyl propionate,propanoic acid, ethyl ester,propionic ester,propionic ether,propionic acid, ethyl ester,ethylpropionate,propionate d'ethyle,propanoic acid ethyl ester,ethyl n-propionate,propionic acid ethyl ester |
| IUPAC Name | ethyl propanoate |
| InChI Key | FKRCODPIKNYEAC-UHFFFAOYSA-N |
| Molecular Formula | C5H10O2 |
Thermo Scientific Chemicals Ethylenediaminetetraacetic acid, Cell Culture Reagent
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 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 |
| InChI Key | KCXVZYZYPLLWCC-UHFFFAOYSA-N |
| Molecular Formula | C10H16N2O8 |
1,2,4-Benzenetricarboxylic anhydride, 97%
CAS: 552-30-7 MDL Number: MFCD00005925 InChI Key: SRPWOOOHEPICQU-UHFFFAOYSA-N Synonym: trimellitic anhydride,1,2,4-benzenetricarboxylic anhydride,anhydrotrimellic acid,trimellitic acid anhydride,4-carboxyphthalic anhydride,tman,anhydrotrimellitic acid,trimellic acid anhydride,1,3-dioxo-1,3-dihydroisobenzofuran-5-carboxylic acid,trimellitic acid 1,2-anhydride PubChem CID: 11089 ChEBI: CHEBI:53050 IUPAC Name: 1,3-dioxo-2-benzofuran-5-carboxylic acid SMILES: C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O
| PubChem CID | 11089 |
|---|---|
| CAS | 552-30-7 |
| ChEBI | CHEBI:53050 |
| MDL Number | MFCD00005925 |
| SMILES | C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O |
| Synonym | trimellitic anhydride,1,2,4-benzenetricarboxylic anhydride,anhydrotrimellic acid,trimellitic acid anhydride,4-carboxyphthalic anhydride,tman,anhydrotrimellitic acid,trimellic acid anhydride,1,3-dioxo-1,3-dihydroisobenzofuran-5-carboxylic acid,trimellitic acid 1,2-anhydride |
| IUPAC Name | 1,3-dioxo-2-benzofuran-5-carboxylic acid |
| InChI Key | SRPWOOOHEPICQU-UHFFFAOYSA-N |
Thioglycolic Acid 98.0+%, TCI America™
CAS: 68-11-1 Molecular Formula: C2H4O2S Molecular Weight (g/mol): 92.112 MDL Number: MFCD00004876 InChI Key: CWERGRDVMFNCDR-UHFFFAOYSA-N Synonym: mercaptoacetic acid,thioglycolic acid,2-thioglycolic acid,acetic acid, mercapto,2-mercaptoacetic acid,sulfanylacetic acid,thiovanic acid,mercaptoessigsaeure,thioglycollic acid,glycolic acid, thio PubChem CID: 1133 ChEBI: CHEBI:30065 IUPAC Name: 2-sulfanylacetic acid SMILES: C(C(=O)O)S
| PubChem CID | 1133 |
|---|---|
| CAS | 68-11-1 |
| Molecular Weight (g/mol) | 92.112 |
| ChEBI | CHEBI:30065 |
| MDL Number | MFCD00004876 |
| SMILES | C(C(=O)O)S |
| Synonym | mercaptoacetic acid,thioglycolic acid,2-thioglycolic acid,acetic acid, mercapto,2-mercaptoacetic acid,sulfanylacetic acid,thiovanic acid,mercaptoessigsaeure,thioglycollic acid,glycolic acid, thio |
| IUPAC Name | 2-sulfanylacetic acid |
| InChI Key | CWERGRDVMFNCDR-UHFFFAOYSA-N |
| Molecular Formula | C2H4O2S |
4-Methylvaleric acid, 99%
CAS: 646-07-1 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00002803 InChI Key: FGKJLKRYENPLQH-UHFFFAOYSA-N Synonym: 4-methylvaleric acid,isocaproic acid,isohexanoic acid,pentanoic acid, 4-methyl,isobutylacetic acid,4-methyl-pentanoic acid,valeric acid, 4-methyl,4-methyl valeric acid,isocaproate,4,4-dimethylbutanoic acid PubChem CID: 12587 ChEBI: CHEBI:74903 IUPAC Name: 4-methylpentanoic acid SMILES: CC(C)CCC(=O)O
| PubChem CID | 12587 |
|---|---|
| CAS | 646-07-1 |
| Molecular Weight (g/mol) | 116.16 |
| ChEBI | CHEBI:74903 |
| MDL Number | MFCD00002803 |
| SMILES | CC(C)CCC(=O)O |
| Synonym | 4-methylvaleric acid,isocaproic acid,isohexanoic acid,pentanoic acid, 4-methyl,isobutylacetic acid,4-methyl-pentanoic acid,valeric acid, 4-methyl,4-methyl valeric acid,isocaproate,4,4-dimethylbutanoic acid |
| IUPAC Name | 4-methylpentanoic acid |
| InChI Key | FGKJLKRYENPLQH-UHFFFAOYSA-N |
| Molecular Formula | C6H12O2 |
Ethyl sorbate, 96%
CAS: 2396-84-1 Molecular Formula: C8H12O2 Molecular Weight (g/mol): 140.18 MDL Number: MFCD00009296 InChI Key: OZZYKXXGCOLLLO-TWTPFVCWSA-N Synonym: ethyl sorbate,ethyl 2,4-hexadienoate,ethyl hexa-2,4-dienoate,sorbic acid, ethyl ester,2,4-hexadienoic acid, ethyl ester,ethyl 2e,4e-hexa-2,4-dienoate,ethyl e,e-2,4-hexadienoate,unii-hsr16usg4d,2,4-hexadienoic acid, ethyl ester, 2e,4e,fema no. 2459 PubChem CID: 1550470 IUPAC Name: ethyl (2E,4E)-hexa-2,4-dienoate SMILES: CCOC(=O)\C=C\C=C\C
| PubChem CID | 1550470 |
|---|---|
| CAS | 2396-84-1 |
| Molecular Weight (g/mol) | 140.18 |
| MDL Number | MFCD00009296 |
| SMILES | CCOC(=O)\C=C\C=C\C |
| Synonym | ethyl sorbate,ethyl 2,4-hexadienoate,ethyl hexa-2,4-dienoate,sorbic acid, ethyl ester,2,4-hexadienoic acid, ethyl ester,ethyl 2e,4e-hexa-2,4-dienoate,ethyl e,e-2,4-hexadienoate,unii-hsr16usg4d,2,4-hexadienoic acid, ethyl ester, 2e,4e,fema no. 2459 |
| IUPAC Name | ethyl (2E,4E)-hexa-2,4-dienoate |
| InChI Key | OZZYKXXGCOLLLO-TWTPFVCWSA-N |
| Molecular Formula | C8H12O2 |
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 |
|---|---|
| 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 |
Thermo Scientific Chemicals o-Cresolphthalein complexone, indicator grade
CAS: 2411-89-4 Molecular Formula: C32H32N2O12 Molecular Weight (g/mol): 636.61 MDL Number: MFCD00005911 InChI Key: IYZPEGVSBUNMBE-UHFFFAOYSA-N Synonym: o-cresolphthalein complexone,phthalein purple,cresolphthalexon,o-cresolphthalexon,phthalein complexon,o-cresolphthalein complexon,cresolphthalein complexon,metal phthalein,cresolphthalein complexone,unii-a4p6737i7f PubChem CID: 75485 IUPAC Name: 2-[[5-[1-[3-[[bis(carboxymethyl)amino]methyl]-4-hydroxy-5-methylphenyl]-3-oxo-2-benzofuran-1-yl]-2-hydroxy-3-methylphenyl]methyl-(carboxymethyl)amino]acetic acid SMILES: CC1=CC(=CC(CN(CC(O)=O)CC(O)=O)=C1O)C1(OC(=O)C2=CC=CC=C12)C1=CC(C)=C(O)C(CN(CC(O)=O)CC(O)=O)=C1
| PubChem CID | 75485 |
|---|---|
| CAS | 2411-89-4 |
| Molecular Weight (g/mol) | 636.61 |
| MDL Number | MFCD00005911 |
| SMILES | CC1=CC(=CC(CN(CC(O)=O)CC(O)=O)=C1O)C1(OC(=O)C2=CC=CC=C12)C1=CC(C)=C(O)C(CN(CC(O)=O)CC(O)=O)=C1 |
| Synonym | o-cresolphthalein complexone,phthalein purple,cresolphthalexon,o-cresolphthalexon,phthalein complexon,o-cresolphthalein complexon,cresolphthalein complexon,metal phthalein,cresolphthalein complexone,unii-a4p6737i7f |
| IUPAC Name | 2-[[5-[1-[3-[[bis(carboxymethyl)amino]methyl]-4-hydroxy-5-methylphenyl]-3-oxo-2-benzofuran-1-yl]-2-hydroxy-3-methylphenyl]methyl-(carboxymethyl)amino]acetic acid |
| InChI Key | IYZPEGVSBUNMBE-UHFFFAOYSA-N |
| Molecular Formula | C32H32N2O12 |
Naproxen sodium, 98%, Thermo Scientific Chemicals
CAS: 26159-34-2 Molecular Formula: C14H13NaO3 Molecular Weight (g/mol): 252.25 MDL Number: MFCD00058507 InChI Key: CDBRNDSHEYLDJV-FVGYRXGTSA-M Synonym: naproxen sodium,anaprox,miranax,naprelan,naproxen sodium salt,anapran,anaprotab,aprowell,floginex,flogogin PubChem CID: 23681059 ChEBI: CHEBI:7477 IUPAC Name: sodium;(2S)-2-(6-methoxynaphthalen-2-yl)propanoate SMILES: [Na+].COC1=CC=C2C=C(C=CC2=C1)[C@H](C)C([O-])=O
| PubChem CID | 23681059 |
|---|---|
| CAS | 26159-34-2 |
| Molecular Weight (g/mol) | 252.25 |
| ChEBI | CHEBI:7477 |
| MDL Number | MFCD00058507 |
| SMILES | [Na+].COC1=CC=C2C=C(C=CC2=C1)[C@H](C)C([O-])=O |
| Synonym | naproxen sodium,anaprox,miranax,naprelan,naproxen sodium salt,anapran,anaprotab,aprowell,floginex,flogogin |
| IUPAC Name | sodium;(2S)-2-(6-methoxynaphthalen-2-yl)propanoate |
| InChI Key | CDBRNDSHEYLDJV-FVGYRXGTSA-M |
| Molecular Formula | C14H13NaO3 |