Organic acids and derivatives
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[(tert-Butoxycarbonyl)aminooxy]acetic Acid 98.0+%, TCI America™
CAS: 42989-85-5 Molecular Formula: C7H13NO5 Molecular Weight (g/mol): 191.183 MDL Number: MFCD01632027 InChI Key: QBXODCKYUZNZCY-UHFFFAOYSA-N Synonym: boc-aminooxy acetic acid,2-tert-butoxycarbonyl amino oxy acetic acid,boc-aoa-oh,boc-aminooxyacetic acid,boc-aoac-oh,n-boc-carboxymethoxy amine,boc-aminooxy aceticacid,2-tert-butoxy carbonyl amino oxy acetic acid,2-2-methylpropan-2-yl oxycarbonylamino oxyacetic acid,tert-butoxycarbonyl aminooxy acetic acid PubChem CID: 2755974 IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]oxyacetic acid SMILES: CC(C)(C)OC(=O)NOCC(=O)O
| PubChem CID | 2755974 |
|---|---|
| CAS | 42989-85-5 |
| Molecular Weight (g/mol) | 191.183 |
| MDL Number | MFCD01632027 |
| SMILES | CC(C)(C)OC(=O)NOCC(=O)O |
| Synonym | boc-aminooxy acetic acid,2-tert-butoxycarbonyl amino oxy acetic acid,boc-aoa-oh,boc-aminooxyacetic acid,boc-aoac-oh,n-boc-carboxymethoxy amine,boc-aminooxy aceticacid,2-tert-butoxy carbonyl amino oxy acetic acid,2-2-methylpropan-2-yl oxycarbonylamino oxyacetic acid,tert-butoxycarbonyl aminooxy acetic acid |
| IUPAC Name | 2-[(2-methylpropan-2-yl)oxycarbonylamino]oxyacetic acid |
| InChI Key | QBXODCKYUZNZCY-UHFFFAOYSA-N |
| Molecular Formula | C7H13NO5 |
p-Tolylacetic Acid 98.0+%, TCI America™
CAS: 622-47-9 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00004353 InChI Key: GXXXUZIRGXYDFP-UHFFFAOYSA-N Synonym: p-tolylacetic acid,4-methylphenylacetic acid,2-p-tolyl acetic acid,2-4-methylphenyl acetic acid,p-methylphenylacetic acid,4-tolylacetic acid,4-methylphenyl acetic acid,benzeneacetic acid, 4-methyl,acetic acid, p-tolyl,2-p-tolylacetic acid PubChem CID: 248474 IUPAC Name: 2-(4-methylphenyl)acetic acid SMILES: CC1=CC=C(C=C1)CC(=O)O
| PubChem CID | 248474 |
|---|---|
| CAS | 622-47-9 |
| Molecular Weight (g/mol) | 150.177 |
| MDL Number | MFCD00004353 |
| SMILES | CC1=CC=C(C=C1)CC(=O)O |
| Synonym | p-tolylacetic acid,4-methylphenylacetic acid,2-p-tolyl acetic acid,2-4-methylphenyl acetic acid,p-methylphenylacetic acid,4-tolylacetic acid,4-methylphenyl acetic acid,benzeneacetic acid, 4-methyl,acetic acid, p-tolyl,2-p-tolylacetic acid |
| IUPAC Name | 2-(4-methylphenyl)acetic acid |
| InChI Key | GXXXUZIRGXYDFP-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
Isoamyl Butyrate 98.0+%, TCI America™
CAS: 106-27-4 Molecular Formula: C9H18O2 Molecular Weight (g/mol): 158.24 MDL Number: MFCD00044888 InChI Key: PQLMXFQTAMDXIZ-UHFFFAOYSA-N Synonym: isoamyl butyrate,isopentyl butyrate,isopentyl butanoate,isoamyl butanoate,butanoic acid, 3-methylbutyl ester,3-methylbutyl butyrate,butyric acid, isopentyl ester,isoamyl-n-butyrate,isopentyl alcohol, butyrate,isoamyl butylate PubChem CID: 7795 ChEBI: CHEBI:87422 IUPAC Name: 3-methylbutyl butanoate SMILES: CCCC(=O)OCCC(C)C
| PubChem CID | 7795 |
|---|---|
| CAS | 106-27-4 |
| Molecular Weight (g/mol) | 158.24 |
| ChEBI | CHEBI:87422 |
| MDL Number | MFCD00044888 |
| SMILES | CCCC(=O)OCCC(C)C |
| Synonym | isoamyl butyrate,isopentyl butyrate,isopentyl butanoate,isoamyl butanoate,butanoic acid, 3-methylbutyl ester,3-methylbutyl butyrate,butyric acid, isopentyl ester,isoamyl-n-butyrate,isopentyl alcohol, butyrate,isoamyl butylate |
| IUPAC Name | 3-methylbutyl butanoate |
| InChI Key | PQLMXFQTAMDXIZ-UHFFFAOYSA-N |
| Molecular Formula | C9H18O2 |
Ethyl 2-Ethyl-2-methylacetoacetate 93.0+%, TCI America™
CAS: 33697-53-9 Molecular Formula: C9H16O3 Molecular Weight (g/mol): 172.224 MDL Number: MFCD00191433 InChI Key: NWMTWESXONQJPU-UHFFFAOYSA-N Synonym: 2-Ethyl-2-methylacetoacetic Acid Ethyl Ester PubChem CID: 582452 IUPAC Name: ethyl 2-ethyl-2-methyl-3-oxobutanoate SMILES: CCC(C)(C(=O)C)C(=O)OCC
| PubChem CID | 582452 |
|---|---|
| CAS | 33697-53-9 |
| Molecular Weight (g/mol) | 172.224 |
| MDL Number | MFCD00191433 |
| SMILES | CCC(C)(C(=O)C)C(=O)OCC |
| Synonym | 2-Ethyl-2-methylacetoacetic Acid Ethyl Ester |
| IUPAC Name | ethyl 2-ethyl-2-methyl-3-oxobutanoate |
| InChI Key | NWMTWESXONQJPU-UHFFFAOYSA-N |
| Molecular Formula | C9H16O3 |
1-Phenyl-1-cyclohexanecarboxylic Acid 95.0+%, TCI America™
CAS: 1135-67-7 Molecular Formula: C13H16O2 Molecular Weight (g/mol): 204.269 MDL Number: MFCD00037152 InChI Key: QXXHHHWXFHPNOS-UHFFFAOYSA-N Synonym: 1-phenylcyclohexanecarboxylic acid,1-phenyl-1-cyclohexanecarboxylic acid,1-phenyl-cyclohexanecarboxylic acid,cyclohexanecarboxylic acid, 1-phenyl,acmc-1c6ij,1-phenylcyclohexanecarboxylicacid,qxxhhhwxfhpnos-uhfffaoysa,1-phenylcyclohexanecarboxylic acid #,cyclohexanecarboxylicacid, 1-phenyl,1-phenyl-1-cyclohexane carboxylic acid PubChem CID: 70817 IUPAC Name: 1-phenylcyclohexane-1-carboxylic acid SMILES: C1CCC(CC1)(C2=CC=CC=C2)C(=O)O
| PubChem CID | 70817 |
|---|---|
| CAS | 1135-67-7 |
| Molecular Weight (g/mol) | 204.269 |
| MDL Number | MFCD00037152 |
| SMILES | C1CCC(CC1)(C2=CC=CC=C2)C(=O)O |
| Synonym | 1-phenylcyclohexanecarboxylic acid,1-phenyl-1-cyclohexanecarboxylic acid,1-phenyl-cyclohexanecarboxylic acid,cyclohexanecarboxylic acid, 1-phenyl,acmc-1c6ij,1-phenylcyclohexanecarboxylicacid,qxxhhhwxfhpnos-uhfffaoysa,1-phenylcyclohexanecarboxylic acid #,cyclohexanecarboxylicacid, 1-phenyl,1-phenyl-1-cyclohexane carboxylic acid |
| IUPAC Name | 1-phenylcyclohexane-1-carboxylic acid |
| InChI Key | QXXHHHWXFHPNOS-UHFFFAOYSA-N |
| Molecular Formula | C13H16O2 |
Ethyl Nonanoate 95.0+%, TCI America™
CAS: 123-29-5 Molecular Formula: C11H22O2 Molecular Weight (g/mol): 186.30 MDL Number: MFCD00009570 InChI Key: BYEVBITUADOIGY-UHFFFAOYSA-N Synonym: ethyl pelargonate,nonanoic acid, ethyl ester,ethyl nonylate,wine ether,nonanoic acid ethyl ester,natural,ethyl n-nonanoate,unii-ksh683s98j,fema no. 2447,pelargonic acid ethyl ester PubChem CID: 31251 ChEBI: CHEBI:87501 IUPAC Name: ethyl nonanoate SMILES: CCCCCCCCC(=O)OCC
| PubChem CID | 31251 |
|---|---|
| CAS | 123-29-5 |
| Molecular Weight (g/mol) | 186.30 |
| ChEBI | CHEBI:87501 |
| MDL Number | MFCD00009570 |
| SMILES | CCCCCCCCC(=O)OCC |
| Synonym | ethyl pelargonate,nonanoic acid, ethyl ester,ethyl nonylate,wine ether,nonanoic acid ethyl ester,natural,ethyl n-nonanoate,unii-ksh683s98j,fema no. 2447,pelargonic acid ethyl ester |
| IUPAC Name | ethyl nonanoate |
| InChI Key | BYEVBITUADOIGY-UHFFFAOYSA-N |
| Molecular Formula | C11H22O2 |
Ethyl Cyclohexylacetate 98.0+%, TCI America™
CAS: 5452-75-5 Molecular Formula: C10H18O2 Molecular Weight (g/mol): 170.25 MDL Number: MFCD00001517 InChI Key: ZBDAMDWKXGTKBT-UHFFFAOYSA-N Synonym: ethyl cyclohexylacetate,ethyl cyclohexaneacetate,cyclohexaneacetic acid, ethyl ester,ethyl-2-cyclohexylacetate,ethylcyclohexylacetate,unii-v36o028g9r,cyclohexylacetic acid ethyl ester,cyclohexaneacetic acid ethyl ester,cyclohexyl acetic acid ethyl ester,pubchem20245 PubChem CID: 21595 IUPAC Name: ethyl 2-cyclohexylacetate SMILES: CCOC(=O)CC1CCCCC1
| PubChem CID | 21595 |
|---|---|
| CAS | 5452-75-5 |
| Molecular Weight (g/mol) | 170.25 |
| MDL Number | MFCD00001517 |
| SMILES | CCOC(=O)CC1CCCCC1 |
| Synonym | ethyl cyclohexylacetate,ethyl cyclohexaneacetate,cyclohexaneacetic acid, ethyl ester,ethyl-2-cyclohexylacetate,ethylcyclohexylacetate,unii-v36o028g9r,cyclohexylacetic acid ethyl ester,cyclohexaneacetic acid ethyl ester,cyclohexyl acetic acid ethyl ester,pubchem20245 |
| IUPAC Name | ethyl 2-cyclohexylacetate |
| InChI Key | ZBDAMDWKXGTKBT-UHFFFAOYSA-N |
| Molecular Formula | C10H18O2 |
Benzyl Laurate 98.0+%, TCI America™
CAS: 140-25-0 Molecular Formula: C19H30O2 Molecular Weight (g/mol): 290.447 MDL Number: MFCD00026558 InChI Key: QNRYOQRUGRVBRL-UHFFFAOYSA-N Synonym: Lauric Acid Benzyl Ester PubChem CID: 8791 IUPAC Name: benzyl dodecanoate SMILES: CCCCCCCCCCCC(=O)OCC1=CC=CC=C1
| PubChem CID | 8791 |
|---|---|
| CAS | 140-25-0 |
| Molecular Weight (g/mol) | 290.447 |
| MDL Number | MFCD00026558 |
| SMILES | CCCCCCCCCCCC(=O)OCC1=CC=CC=C1 |
| Synonym | Lauric Acid Benzyl Ester |
| IUPAC Name | benzyl dodecanoate |
| InChI Key | QNRYOQRUGRVBRL-UHFFFAOYSA-N |
| Molecular Formula | C19H30O2 |
Amyl Hexanoate 98.0+%, TCI America™
CAS: 540-07-8 Molecular Formula: C11H22O2 Molecular Weight (g/mol): 186.295 MDL Number: MFCD00027281 InChI Key: WRFZKAGPPQGDDQ-UHFFFAOYSA-N Synonym: Hexanoic Acid Amyl Ester, Pentyl Hexanoate, Hexanoic Acid Pentyl Ester PubChem CID: 10886 IUPAC Name: pentyl hexanoate SMILES: CCCCCC(=O)OCCCCC
| PubChem CID | 10886 |
|---|---|
| CAS | 540-07-8 |
| Molecular Weight (g/mol) | 186.295 |
| MDL Number | MFCD00027281 |
| SMILES | CCCCCC(=O)OCCCCC |
| Synonym | Hexanoic Acid Amyl Ester, Pentyl Hexanoate, Hexanoic Acid Pentyl Ester |
| IUPAC Name | pentyl hexanoate |
| InChI Key | WRFZKAGPPQGDDQ-UHFFFAOYSA-N |
| Molecular Formula | C11H22O2 |
2-Propylvaleric Acid 99.0+%, TCI America™
CAS: 99-66-1 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.21 MDL Number: MFCD00002672 InChI Key: NIJJYAXOARWZEE-UHFFFAOYSA-N Synonym: valproic acid,dipropylacetic acid,depakene,depakine,2-propylvaleric acid,ergenyl,di-n-propylacetic acid,valproate,mylproin,pentanoic acid, 2-propyl PubChem CID: 3121 ChEBI: CHEBI:39867 IUPAC Name: 2-propylpentanoic acid SMILES: CCCC(CCC)C(O)=O
| PubChem CID | 3121 |
|---|---|
| CAS | 99-66-1 |
| Molecular Weight (g/mol) | 144.21 |
| ChEBI | CHEBI:39867 |
| MDL Number | MFCD00002672 |
| SMILES | CCCC(CCC)C(O)=O |
| Synonym | valproic acid,dipropylacetic acid,depakene,depakine,2-propylvaleric acid,ergenyl,di-n-propylacetic acid,valproate,mylproin,pentanoic acid, 2-propyl |
| IUPAC Name | 2-propylpentanoic acid |
| InChI Key | NIJJYAXOARWZEE-UHFFFAOYSA-N |
| Molecular Formula | C8H16O2 |
Ethyl Cyclobutanecarboxylate 98.0+%, TCI America™
CAS: 14924-53-9 Molecular Formula: C7H12O2 Molecular Weight (g/mol): 128.17 MDL Number: MFCD00001321 InChI Key: SMVBADCAMQOTOV-UHFFFAOYSA-N Synonym: Cyclobutanecarboxylic Acid Ethyl Ester PubChem CID: 84700 IUPAC Name: ethyl cyclobutanecarboxylate SMILES: CCOC(=O)C1CCC1
| PubChem CID | 84700 |
|---|---|
| CAS | 14924-53-9 |
| Molecular Weight (g/mol) | 128.17 |
| MDL Number | MFCD00001321 |
| SMILES | CCOC(=O)C1CCC1 |
| Synonym | Cyclobutanecarboxylic Acid Ethyl Ester |
| IUPAC Name | ethyl cyclobutanecarboxylate |
| InChI Key | SMVBADCAMQOTOV-UHFFFAOYSA-N |
| Molecular Formula | C7H12O2 |
Isopropyl Formate 97.0+%, TCI America™
CAS: 625-55-8 Molecular Formula: C4H8O2 Molecular Weight (g/mol): 88.11 MDL Number: MFCD00014127 InChI Key: RMOUBSOVHSONPZ-UHFFFAOYSA-N Synonym: isopropyl formate,formic acid, 1-methylethyl ester,formic acid isopropyl ester,formic acid, isopropyl ester,isopropyl methanoate,1-methylethyl formate,methylethyl formate,unii-h1l164w42g,fema no. 2944,hcooch ch3 2 PubChem CID: 12257 IUPAC Name: propan-2-yl formate SMILES: CC(C)OC=O
| PubChem CID | 12257 |
|---|---|
| CAS | 625-55-8 |
| Molecular Weight (g/mol) | 88.11 |
| MDL Number | MFCD00014127 |
| SMILES | CC(C)OC=O |
| Synonym | isopropyl formate,formic acid, 1-methylethyl ester,formic acid isopropyl ester,formic acid, isopropyl ester,isopropyl methanoate,1-methylethyl formate,methylethyl formate,unii-h1l164w42g,fema no. 2944,hcooch ch3 2 |
| IUPAC Name | propan-2-yl formate |
| InChI Key | RMOUBSOVHSONPZ-UHFFFAOYSA-N |
| Molecular Formula | C4H8O2 |
3,4-Diethyl-2-ethoxycarbonyl-5-methylpyrrole 96.0+%, TCI America™
CAS: 16200-50-3 Molecular Formula: C12H19NO2 Molecular Weight (g/mol): 209.289 MDL Number: MFCD00075089 InChI Key: YXAABSBFWADBRO-UHFFFAOYSA-N Synonym: 3,4-Diethyl-5-methyl-2-pyrrolecarboxylic Acid Ethyl Ester, Ethyl 3,4-Diethyl-5-methyl-2-pyrrolecarboxylate PubChem CID: 590710 IUPAC Name: ethyl 3,4-diethyl-5-methyl-1H-pyrrole-2-carboxylate SMILES: CCC1=C(NC(=C1CC)C(=O)OCC)C
| PubChem CID | 590710 |
|---|---|
| CAS | 16200-50-3 |
| Molecular Weight (g/mol) | 209.289 |
| MDL Number | MFCD00075089 |
| SMILES | CCC1=C(NC(=C1CC)C(=O)OCC)C |
| Synonym | 3,4-Diethyl-5-methyl-2-pyrrolecarboxylic Acid Ethyl Ester, Ethyl 3,4-Diethyl-5-methyl-2-pyrrolecarboxylate |
| IUPAC Name | ethyl 3,4-diethyl-5-methyl-1H-pyrrole-2-carboxylate |
| InChI Key | YXAABSBFWADBRO-UHFFFAOYSA-N |
| Molecular Formula | C12H19NO2 |
Amyl Butyrate 98.0+%, TCI America™
CAS: 540-18-1 Molecular Formula: C9H18O2 Molecular Weight (g/mol): 158.24 MDL Number: MFCD00048850 InChI Key: CFNJLPHOBMVMNS-UHFFFAOYSA-N Synonym: pentyl butyrate,amyl butyrate,n-amyl butyrate,butanoic acid, pentyl ester,amyl butanoate,1-pentyl butyrate,n-pentyl butanoate,n-pentyl n-butyrate,n-pentyl butyrate,butyric acid, pentyl ester PubChem CID: 10890 ChEBI: CHEBI:87684 IUPAC Name: pentyl butanoate SMILES: CCCCCOC(=O)CCC
| PubChem CID | 10890 |
|---|---|
| CAS | 540-18-1 |
| Molecular Weight (g/mol) | 158.24 |
| ChEBI | CHEBI:87684 |
| MDL Number | MFCD00048850 |
| SMILES | CCCCCOC(=O)CCC |
| Synonym | pentyl butyrate,amyl butyrate,n-amyl butyrate,butanoic acid, pentyl ester,amyl butanoate,1-pentyl butyrate,n-pentyl butanoate,n-pentyl n-butyrate,n-pentyl butyrate,butyric acid, pentyl ester |
| IUPAC Name | pentyl butanoate |
| InChI Key | CFNJLPHOBMVMNS-UHFFFAOYSA-N |
| Molecular Formula | C9H18O2 |
Hexyl Hexanoate 98.0+%, TCI America™
CAS: 6378-65-0 Molecular Formula: C12H24O2 Molecular Weight (g/mol): 200.32 MDL Number: MFCD00053808 InChI Key: NCDCLPBOMHPFCV-UHFFFAOYSA-N Synonym: Hexanoic Acid Hexyl Ester PubChem CID: 22873 IUPAC Name: hexyl hexanoate SMILES: CCCCCCOC(=O)CCCCC
| PubChem CID | 22873 |
|---|---|
| CAS | 6378-65-0 |
| Molecular Weight (g/mol) | 200.32 |
| MDL Number | MFCD00053808 |
| SMILES | CCCCCCOC(=O)CCCCC |
| Synonym | Hexanoic Acid Hexyl Ester |
| IUPAC Name | hexyl hexanoate |
| InChI Key | NCDCLPBOMHPFCV-UHFFFAOYSA-N |
| Molecular Formula | C12H24O2 |