Carboxylic acids and derivatives
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2-Naphthylacetic acid, 99%
CAS: 581-96-4 Molecular Formula: C12H10O2 Molecular Weight (g/mol): 186.21 MDL Number: MFCD00004126 InChI Key: VIBOGIYPPWLDTI-UHFFFAOYSA-N Synonym: 2-naphthylacetic acid,2-naphthaleneacetic acid,2-naphthalen-2-yl acetic acid,betoxan,2-2-naphthyl acetic acid,beta-naphthylacetic acid,beta-naphthaleneacetic acid,beta-naphthaleneacetate,naphthalen-2-ylacetic acid,.beta.-naphthaleneacetic acid PubChem CID: 11393 ChEBI: CHEBI:37837 IUPAC Name: 2-naphthalen-2-ylacetic acid SMILES: OC(=O)CC1=CC=C2C=CC=CC2=C1
| PubChem CID | 11393 |
|---|---|
| CAS | 581-96-4 |
| Molecular Weight (g/mol) | 186.21 |
| ChEBI | CHEBI:37837 |
| MDL Number | MFCD00004126 |
| SMILES | OC(=O)CC1=CC=C2C=CC=CC2=C1 |
| Synonym | 2-naphthylacetic acid,2-naphthaleneacetic acid,2-naphthalen-2-yl acetic acid,betoxan,2-2-naphthyl acetic acid,beta-naphthylacetic acid,beta-naphthaleneacetic acid,beta-naphthaleneacetate,naphthalen-2-ylacetic acid,.beta.-naphthaleneacetic acid |
| IUPAC Name | 2-naphthalen-2-ylacetic acid |
| InChI Key | VIBOGIYPPWLDTI-UHFFFAOYSA-N |
| Molecular Formula | C12H10O2 |
Methyl Acetate, 96%, Spectrum™ Chemical
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CAS: 79-20-9
| CAS | 79-20-9 |
|---|
5,6-Dihydrouracil, 97%
CAS: 504-07-4 Molecular Formula: C4H6N2O2 Molecular Weight (g/mol): 114.10 MDL Number: MFCD00006029 InChI Key: OIVLITBTBDPEFK-UHFFFAOYSA-N Synonym: dihydrouracil,5,6-dihydrouracil,hydrouracil,5,6-dihydro-2,4-dihydroxypyrimidine,dihydropyrimidine-2,4 1h,3h-dione,dihydrouracile,2,4 1h,3h-pyrimidinedione, dihydro,di-h-uracil,dihydro-2,4 1h,3h-pyrimidinedione,hydrouracil 8ci PubChem CID: 649 ChEBI: CHEBI:15901 IUPAC Name: 1,3-diazinane-2,4-dione SMILES: O=C1CCNC(=O)N1
| PubChem CID | 649 |
|---|---|
| CAS | 504-07-4 |
| Molecular Weight (g/mol) | 114.10 |
| ChEBI | CHEBI:15901 |
| MDL Number | MFCD00006029 |
| SMILES | O=C1CCNC(=O)N1 |
| Synonym | dihydrouracil,5,6-dihydrouracil,hydrouracil,5,6-dihydro-2,4-dihydroxypyrimidine,dihydropyrimidine-2,4 1h,3h-dione,dihydrouracile,2,4 1h,3h-pyrimidinedione, dihydro,di-h-uracil,dihydro-2,4 1h,3h-pyrimidinedione,hydrouracil 8ci |
| IUPAC Name | 1,3-diazinane-2,4-dione |
| InChI Key | OIVLITBTBDPEFK-UHFFFAOYSA-N |
| Molecular Formula | C4H6N2O2 |
Ethylene glycol-bis-(β-aminoethylether)-N,N,N',N'-tetraacetic acid, 99.6%, MP Biomedicals™
CAS: 67-42-5 Molecular Formula: C14H24N2O10 Molecular Weight (g/mol): 380.35 InChI Key: DEFVIWRASFVYLL-UHFFFAOYSA-N Synonym: egta,egtazic acid,gedta,ethylenebis oxyethylenenitrilo tetraacetic acid,ebonta,6,9-dioxa-3,12-diazatetradecanedioic acid, 3,12-bis carboxymethyl,1,2-bis 2-bis carboxymethyl amino ethoxy ethane,ethylene glycol tetraacetic acid,h4egta,egtazic acid usan:inn PubChem CID: 6207 ChEBI: CHEBI:30740 IUPAC Name: 2-[2-[2-[2-[bis(carboxymethyl)amino]ethoxy]ethoxy]ethyl-(carboxymethyl)amino]acetic acid SMILES: C(COCCOCCN(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O
| PubChem CID | 6207 |
|---|---|
| CAS | 67-42-5 |
| Molecular Weight (g/mol) | 380.35 |
| ChEBI | CHEBI:30740 |
| SMILES | C(COCCOCCN(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O |
| Synonym | egta,egtazic acid,gedta,ethylenebis oxyethylenenitrilo tetraacetic acid,ebonta,6,9-dioxa-3,12-diazatetradecanedioic acid, 3,12-bis carboxymethyl,1,2-bis 2-bis carboxymethyl amino ethoxy ethane,ethylene glycol tetraacetic acid,h4egta,egtazic acid usan:inn |
| IUPAC Name | 2-[2-[2-[2-[bis(carboxymethyl)amino]ethoxy]ethoxy]ethyl-(carboxymethyl)amino]acetic acid |
| InChI Key | DEFVIWRASFVYLL-UHFFFAOYSA-N |
| Molecular Formula | C14H24N2O10 |
Methyl 2-chloropropionate, 97%
CAS: 17639-93-9 Molecular Formula: C4H7ClO2 Molecular Weight (g/mol): 122.55 MDL Number: MFCD00000863 InChI Key: JLEJCNOTNLZCHQ-UHFFFAOYNA-N Synonym: methyl 2-chloropropionate,propanoic acid, 2-chloro-, methyl ester,2-chloropropionic acid methyl ester,propionic acid, 2-chloro-, methyl ester,methyl alpha-chloropropionate,methyl .alpha.-chloropropionate,.alpha.-chloropropionic acid methyl ester,propanoic acid, 2-chloro-, methyl ester, s,ch3chclc o och3,acmc-1bl6f PubChem CID: 28659 IUPAC Name: methyl 2-chloropropanoate SMILES: COC(=O)C(C)Cl
| PubChem CID | 28659 |
|---|---|
| CAS | 17639-93-9 |
| Molecular Weight (g/mol) | 122.55 |
| MDL Number | MFCD00000863 |
| SMILES | COC(=O)C(C)Cl |
| Synonym | methyl 2-chloropropionate,propanoic acid, 2-chloro-, methyl ester,2-chloropropionic acid methyl ester,propionic acid, 2-chloro-, methyl ester,methyl alpha-chloropropionate,methyl .alpha.-chloropropionate,.alpha.-chloropropionic acid methyl ester,propanoic acid, 2-chloro-, methyl ester, s,ch3chclc o och3,acmc-1bl6f |
| IUPAC Name | methyl 2-chloropropanoate |
| InChI Key | JLEJCNOTNLZCHQ-UHFFFAOYNA-N |
| Molecular Formula | C4H7ClO2 |
Methyl p-toluate, 99%
CAS: 99-75-2 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00008441 InChI Key: QSSJZLPUHJDYKF-UHFFFAOYSA-N Synonym: methyl p-toluate,methyl-p-toluate,p-carbomethoxytoluene,methyl 4-toluate,4-methylbenzoic acid methyl ester,methyl p-methylbenzoate,benzoic acid, 4-methyl-, methyl ester,4-methoxycarbonyl toluene,p-toluic acid, methyl ester,methyl p-toluenecarboxylate PubChem CID: 7455 IUPAC Name: methyl 4-methylbenzoate SMILES: CC1=CC=C(C=C1)C(=O)OC
| PubChem CID | 7455 |
|---|---|
| CAS | 99-75-2 |
| Molecular Weight (g/mol) | 150.177 |
| MDL Number | MFCD00008441 |
| SMILES | CC1=CC=C(C=C1)C(=O)OC |
| Synonym | methyl p-toluate,methyl-p-toluate,p-carbomethoxytoluene,methyl 4-toluate,4-methylbenzoic acid methyl ester,methyl p-methylbenzoate,benzoic acid, 4-methyl-, methyl ester,4-methoxycarbonyl toluene,p-toluic acid, methyl ester,methyl p-toluenecarboxylate |
| IUPAC Name | methyl 4-methylbenzoate |
| InChI Key | QSSJZLPUHJDYKF-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
Thermo Scientific Chemicals (-)-Epigallocatechin gallate, 95%
CAS: 989-51-5 Molecular Formula: C22H18O11 Molecular Weight (g/mol): 458.37 InChI Key: WMBWREPUVVBILR-WIYYLYMNSA-N Synonym: =--epigallocatechin gallate,egcg,epigallocatechin gallate,epigallocatechin 3-gallate,tea catechin,epigallocatechin-3-gallate,=--epigallocatechin-3-o-gallate,teavigo,=--epigallocatechol gallate,epigallocatechin-3-monogallate PubChem CID: 65064 ChEBI: CHEBI:4806 IUPAC Name: [(2R,3R)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate SMILES: C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O
| PubChem CID | 65064 |
|---|---|
| CAS | 989-51-5 |
| Molecular Weight (g/mol) | 458.37 |
| ChEBI | CHEBI:4806 |
| SMILES | C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O |
| Synonym | =--epigallocatechin gallate,egcg,epigallocatechin gallate,epigallocatechin 3-gallate,tea catechin,epigallocatechin-3-gallate,=--epigallocatechin-3-o-gallate,teavigo,=--epigallocatechol gallate,epigallocatechin-3-monogallate |
| IUPAC Name | [(2R,3R)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate |
| InChI Key | WMBWREPUVVBILR-WIYYLYMNSA-N |
| Molecular Formula | C22H18O11 |
tert-Butyl propiolate, 98%
CAS: 13831-03-3 Molecular Formula: C7H10O2 Molecular Weight (g/mol): 126.16 MDL Number: MFCD00060100 InChI Key: XGTPDIIFEPTULX-UHFFFAOYSA-N Synonym: tert-butyl propiolate,propiolic acid tert-butyl ester,t-butyl propiolate,2-propynoic acid, 1,1-dimethylethyl ester,boc-acetylene,tert-butyl propalate,tert-butyl propargylate,acmc-209chj,tert-butyl propiolate # PubChem CID: 543038 IUPAC Name: tert-butyl prop-2-ynoate SMILES: CC(C)(C)OC(=O)C#C
| PubChem CID | 543038 |
|---|---|
| CAS | 13831-03-3 |
| Molecular Weight (g/mol) | 126.16 |
| MDL Number | MFCD00060100 |
| SMILES | CC(C)(C)OC(=O)C#C |
| Synonym | tert-butyl propiolate,propiolic acid tert-butyl ester,t-butyl propiolate,2-propynoic acid, 1,1-dimethylethyl ester,boc-acetylene,tert-butyl propalate,tert-butyl propargylate,acmc-209chj,tert-butyl propiolate # |
| IUPAC Name | tert-butyl prop-2-ynoate |
| InChI Key | XGTPDIIFEPTULX-UHFFFAOYSA-N |
| Molecular Formula | C7H10O2 |
Oxindole, 97%, pure
CAS: 59-48-3 Molecular Formula: C8H7NO Molecular Weight (g/mol): 133.15 MDL Number: MFCD00005711 InChI Key: JYGFTBXVXVMTGB-UHFFFAOYSA-N Synonym: oxindole,indolin-2-one,2-oxindole,2-indolinone,1,3-dihydro-2h-indol-2-one,oxindol,2-oxoindoline,2-oxindoline,indol-2 3h-one,2h-indol-2-one, 1,3-dihydro PubChem CID: 321710 ChEBI: CHEBI:31697 IUPAC Name: 1,3-dihydroindol-2-one SMILES: C1C2=CC=CC=C2NC1=O
| PubChem CID | 321710 |
|---|---|
| CAS | 59-48-3 |
| Molecular Weight (g/mol) | 133.15 |
| ChEBI | CHEBI:31697 |
| MDL Number | MFCD00005711 |
| SMILES | C1C2=CC=CC=C2NC1=O |
| Synonym | oxindole,indolin-2-one,2-oxindole,2-indolinone,1,3-dihydro-2h-indol-2-one,oxindol,2-oxoindoline,2-oxindoline,indol-2 3h-one,2h-indol-2-one, 1,3-dihydro |
| IUPAC Name | 1,3-dihydroindol-2-one |
| InChI Key | JYGFTBXVXVMTGB-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO |
Methyl trans-2-pentenoate, 95%
CAS: 15790-88-2 Molecular Formula: C6H10O2 Molecular Weight (g/mol): 114.14 MDL Number: MFCD00137611 InChI Key: MBAHGFJTIVZLFB-SNAWJCMRSA-N Synonym: methyl 2-pentenoate,methyl trans-2-pentenoate,methyl 2e-pent-2-enoate,2-pentenoic acid, methyl ester,2-pentenoic acid, methyl ester, e,methyl 3-ethylacrylate,methyl 2-transpentenoate,methyl 2-trans-pentenoate,methyl e-2-pentenoate,trans-methyl pent-2-enoate PubChem CID: 5364718 SMILES: CC\C=C\C(=O)OC
| PubChem CID | 5364718 |
|---|---|
| CAS | 15790-88-2 |
| Molecular Weight (g/mol) | 114.14 |
| MDL Number | MFCD00137611 |
| SMILES | CC\C=C\C(=O)OC |
| Synonym | methyl 2-pentenoate,methyl trans-2-pentenoate,methyl 2e-pent-2-enoate,2-pentenoic acid, methyl ester,2-pentenoic acid, methyl ester, e,methyl 3-ethylacrylate,methyl 2-transpentenoate,methyl 2-trans-pentenoate,methyl e-2-pentenoate,trans-methyl pent-2-enoate |
| InChI Key | MBAHGFJTIVZLFB-SNAWJCMRSA-N |
| Molecular Formula | C6H10O2 |
Ethylenediaminetetraacetic Acid Tetrasodium Salt, Solution, Spectrum™ Chemical
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CAS: 64-02-8 Molecular Formula: C10H12N2Na4O8 Molecular Weight (g/mol): 380.17 InChI Key: UEUXEKPTXMALOB-UHFFFAOYSA-J IUPAC Name: tetrasodium 2-({2-[bis(carboxylatomethyl)amino]ethyl}(carboxylatomethyl)amino)acetate SMILES: [Na+].[Na+].[Na+].[Na+].[O-]C(=O)CN(CCN(CC([O-])=O)CC([O-])=O)CC([O-])=O
| CAS | 64-02-8 |
|---|---|
| Molecular Weight (g/mol) | 380.17 |
| SMILES | [Na+].[Na+].[Na+].[Na+].[O-]C(=O)CN(CCN(CC([O-])=O)CC([O-])=O)CC([O-])=O |
| IUPAC Name | tetrasodium 2-({2-[bis(carboxylatomethyl)amino]ethyl}(carboxylatomethyl)amino)acetate |
| InChI Key | UEUXEKPTXMALOB-UHFFFAOYSA-J |
| Molecular Formula | C10H12N2Na4O8 |
cis-1,2,3,6-Tetrahydrophthalimide, 96%, Thermo Scientific™
CAS: 1469-48-3 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.16 MDL Number: MFCD00005880 InChI Key: CIFFBTOJCKSRJY-OLQVQODUSA-N Synonym: cis-1,2,3,6-tetrahydrophthalimide,cis-3a,4,7,7a-tetrahydro-1h-isoindole-1,3 2h-dione,cis-4-cyclohexene-1,2-dicarboximide,cis-tetrahydrophthalimide,unii-es57d28o1u,4-cyclohexene-1,2-dicarboximide, cis,cis-.delta.4-tetrahydrophthalimide,1h-isoindole-1,3 2h-dione, 3a,4,7,7a-tetrahydro-, cis,1h-isoindole-1,3 2h-dione, 3a,4,7,7a-tetrahydro-, 3ar,7as-rel,3ar,7as-3a,4,7,7a-tetrahydroisoindole-1,3-dione PubChem CID: 92888 IUPAC Name: (3aR,7aS)-3a,4,7,7a-tetrahydroisoindole-1,3-dione SMILES: C1C=CCC2C1C(=O)NC2=O
| PubChem CID | 92888 |
|---|---|
| CAS | 1469-48-3 |
| Molecular Weight (g/mol) | 151.16 |
| MDL Number | MFCD00005880 |
| SMILES | C1C=CCC2C1C(=O)NC2=O |
| Synonym | cis-1,2,3,6-tetrahydrophthalimide,cis-3a,4,7,7a-tetrahydro-1h-isoindole-1,3 2h-dione,cis-4-cyclohexene-1,2-dicarboximide,cis-tetrahydrophthalimide,unii-es57d28o1u,4-cyclohexene-1,2-dicarboximide, cis,cis-.delta.4-tetrahydrophthalimide,1h-isoindole-1,3 2h-dione, 3a,4,7,7a-tetrahydro-, cis,1h-isoindole-1,3 2h-dione, 3a,4,7,7a-tetrahydro-, 3ar,7as-rel,3ar,7as-3a,4,7,7a-tetrahydroisoindole-1,3-dione |
| IUPAC Name | (3aR,7aS)-3a,4,7,7a-tetrahydroisoindole-1,3-dione |
| InChI Key | CIFFBTOJCKSRJY-OLQVQODUSA-N |
| Molecular Formula | C8H9NO2 |
Bismuth Subgallate, Powder, Purified, Approx. 55%, Spectrum™ Chemical
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CAS: 99-26-3
| CAS | 99-26-3 |
|---|
Methyl formate, 97%, may cont. up to ca 3% methanol
CAS: 107-31-3 Molecular Formula: C2H4O2 Molecular Weight (g/mol): 60.05 MDL Number: MFCD00003291 InChI Key: TZIHFWKZFHZASV-UHFFFAOYSA-N Synonym: formic acid, methyl ester,methyl methanoate,methylformiat,formic acid methyl ester,formiate de methyle,methylformiaat,mravencan methylnaty,methylformate,caswell no. 570,hcooch3 PubChem CID: 7865 ChEBI: CHEBI:77699 IUPAC Name: methyl formate SMILES: COC=O
| PubChem CID | 7865 |
|---|---|
| CAS | 107-31-3 |
| Molecular Weight (g/mol) | 60.05 |
| ChEBI | CHEBI:77699 |
| MDL Number | MFCD00003291 |
| SMILES | COC=O |
| Synonym | formic acid, methyl ester,methyl methanoate,methylformiat,formic acid methyl ester,formiate de methyle,methylformiaat,mravencan methylnaty,methylformate,caswell no. 570,hcooch3 |
| IUPAC Name | methyl formate |
| InChI Key | TZIHFWKZFHZASV-UHFFFAOYSA-N |
| Molecular Formula | C2H4O2 |
Ethyl 4-aminophenylacetate, 98%
CAS: 5438-70-0 Molecular Formula: C10H13NO2 Molecular Weight (g/mol): 179.219 MDL Number: MFCD00017569 InChI Key: CFNDVXUTYPXOPG-UHFFFAOYSA-N Synonym: ethyl 4-aminophenylacetate,ethyl 2-4-aminophenyl acetate,p-aminophenylacetic acid ethyl ester,4-aminophenylacetic acid ethyl ester,ethyl 4-aminophenyl acetate,ethyl p-aminophenylacetate,unii-5h8cfu7gnp,benzeneacetic acid, 4-amino-, ethyl ester,ethyl-4-aminophenylacetate PubChem CID: 225219 IUPAC Name: ethyl 2-(4-aminophenyl)acetate SMILES: CCOC(=O)CC1=CC=C(C=C1)N
| PubChem CID | 225219 |
|---|---|
| CAS | 5438-70-0 |
| Molecular Weight (g/mol) | 179.219 |
| MDL Number | MFCD00017569 |
| SMILES | CCOC(=O)CC1=CC=C(C=C1)N |
| Synonym | ethyl 4-aminophenylacetate,ethyl 2-4-aminophenyl acetate,p-aminophenylacetic acid ethyl ester,4-aminophenylacetic acid ethyl ester,ethyl 4-aminophenyl acetate,ethyl p-aminophenylacetate,unii-5h8cfu7gnp,benzeneacetic acid, 4-amino-, ethyl ester,ethyl-4-aminophenylacetate |
| IUPAC Name | ethyl 2-(4-aminophenyl)acetate |
| InChI Key | CFNDVXUTYPXOPG-UHFFFAOYSA-N |
| Molecular Formula | C10H13NO2 |