Organic acids and derivatives
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4-Dodecyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophene 98.0+%, TCI America™
CAS: 1173788-58-3 Molecular Formula: C22H39BO2S Molecular Weight (g/mol): 378.42 MDL Number: MFCD22124727 InChI Key: KFTOUTPAXZWQLP-UHFFFAOYSA-N Synonym: 2-(4-Dodecyl-2-thienyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, 4-Dodecyl-2-thiopheneboronic Acid Pinacol Ester PubChem CID: 71306582 IUPAC Name: 2-(4-dodecylthiophen-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane SMILES: CCCCCCCCCCCCC1=CSC(=C1)B1OC(C)(C)C(C)(C)O1
| PubChem CID | 71306582 |
|---|---|
| CAS | 1173788-58-3 |
| Molecular Weight (g/mol) | 378.42 |
| MDL Number | MFCD22124727 |
| SMILES | CCCCCCCCCCCCC1=CSC(=C1)B1OC(C)(C)C(C)(C)O1 |
| Synonym | 2-(4-Dodecyl-2-thienyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, 4-Dodecyl-2-thiopheneboronic Acid Pinacol Ester |
| IUPAC Name | 2-(4-dodecylthiophen-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| InChI Key | KFTOUTPAXZWQLP-UHFFFAOYSA-N |
| Molecular Formula | C22H39BO2S |
Guanine Hydrochloride Hydrate 98.0+%, TCI America™
CAS: 635-39-2 Molecular Formula: C5H6ClN5O Molecular Weight (g/mol): 187.59 MDL Number: MFCD00213670 InChI Key: IBAOFQIOOBQLHE-UHFFFAOYSA-N Synonym: guanine hydrochloride,guanine hcl,2-amino-1h-purin-6 7h-one hydrochloride,guanine, monohydrochloride,usaf s-1,guanine, hydrochloride,6h-purin-6-one, 2-amino-1,7-dihydro-, monohydrochloride,2-amino-9h-purin-6-ol hydrochloride 1:1,6h-purin-6-one, 2-amino-1,9-dihydro-, hydrochloride 1:1,2-amino-3,7-dihydropurin-6-one hydrochloride PubChem CID: 69459 IUPAC Name: 2-amino-6,7-dihydro-3H-purin-6-one hydrochloride SMILES: Cl.NC1=NC(=O)C2=C(N1)N=CN2
| PubChem CID | 69459 |
|---|---|
| CAS | 635-39-2 |
| Molecular Weight (g/mol) | 187.59 |
| MDL Number | MFCD00213670 |
| SMILES | Cl.NC1=NC(=O)C2=C(N1)N=CN2 |
| Synonym | guanine hydrochloride,guanine hcl,2-amino-1h-purin-6 7h-one hydrochloride,guanine, monohydrochloride,usaf s-1,guanine, hydrochloride,6h-purin-6-one, 2-amino-1,7-dihydro-, monohydrochloride,2-amino-9h-purin-6-ol hydrochloride 1:1,6h-purin-6-one, 2-amino-1,9-dihydro-, hydrochloride 1:1,2-amino-3,7-dihydropurin-6-one hydrochloride |
| IUPAC Name | 2-amino-6,7-dihydro-3H-purin-6-one hydrochloride |
| InChI Key | IBAOFQIOOBQLHE-UHFFFAOYSA-N |
| Molecular Formula | C5H6ClN5O |
tert-Butyl Acetate 99.0+%, TCI America™
CAS: 540-88-5 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00008807 InChI Key: WMOVHXAZOJBABW-UHFFFAOYSA-N Synonym: t-butyl acetate,acetic acid tert-butyl ester,tert-butyl ethanoate,acetic acid, 1,1-dimethylethyl ester,texaco lead appreciator,acetic acid, tert-butyl ester,tert-butylacetate,tert butyl acetate,1,1-dimethylethyl acetate,1,1-dimethyl acetate PubChem CID: 10908 IUPAC Name: tert-butyl acetate SMILES: CC(=O)OC(C)(C)C
| PubChem CID | 10908 |
|---|---|
| CAS | 540-88-5 |
| Molecular Weight (g/mol) | 116.16 |
| MDL Number | MFCD00008807 |
| SMILES | CC(=O)OC(C)(C)C |
| Synonym | t-butyl acetate,acetic acid tert-butyl ester,tert-butyl ethanoate,acetic acid, 1,1-dimethylethyl ester,texaco lead appreciator,acetic acid, tert-butyl ester,tert-butylacetate,tert butyl acetate,1,1-dimethylethyl acetate,1,1-dimethyl acetate |
| IUPAC Name | tert-butyl acetate |
| InChI Key | WMOVHXAZOJBABW-UHFFFAOYSA-N |
| Molecular Formula | C6H12O2 |
Methyl Dichloromethoxyacetate 95.0+%, TCI America™
CAS: 17640-25-4 Molecular Formula: C4H6Cl2O3 Molecular Weight (g/mol): 172.989 MDL Number: MFCD00012202 InChI Key: FWIGIASHGJFYOL-UHFFFAOYSA-N PubChem CID: 2724502 IUPAC Name: methyl 2,2-dichloro-2-methoxyacetate SMILES: COC(=O)C(OC)(Cl)Cl
| PubChem CID | 2724502 |
|---|---|
| CAS | 17640-25-4 |
| Molecular Weight (g/mol) | 172.989 |
| MDL Number | MFCD00012202 |
| SMILES | COC(=O)C(OC)(Cl)Cl |
| IUPAC Name | methyl 2,2-dichloro-2-methoxyacetate |
| InChI Key | FWIGIASHGJFYOL-UHFFFAOYSA-N |
| Molecular Formula | C4H6Cl2O3 |
N,N'-Ethylenebisacrylamide 97.0+%, TCI America™
CAS: 2956-58-3 Molecular Formula: C8H12N2O2 Molecular Weight (g/mol): 168.196 MDL Number: MFCD00042935 InChI Key: AYGYHGXUJBFUJU-UHFFFAOYSA-N Synonym: n,n'-ethylenebisacrylamide,n,n-ethylenebisacrylamide,ethylene bis acrylamide,n,n'-ethane-1,2-diyl diacrylamide,2-propenamide, n,n'-1,2-ethanediylbis,n,n'-bis acryloyl-1,2-diaminoethane,n,n'-bis acryloyl-1,2-diaminoethane, stabilized with hydroquinone,n-2-prop-2-enoylamino ethyl prop-2-enamide,n-2-prop-2-enamido ethyl prop-2-enamide,ethylenebisacrylamide PubChem CID: 168964 IUPAC Name: N-[2-(prop-2-enoylamino)ethyl]prop-2-enamide SMILES: C=CC(=O)NCCNC(=O)C=C
| PubChem CID | 168964 |
|---|---|
| CAS | 2956-58-3 |
| Molecular Weight (g/mol) | 168.196 |
| MDL Number | MFCD00042935 |
| SMILES | C=CC(=O)NCCNC(=O)C=C |
| Synonym | n,n'-ethylenebisacrylamide,n,n-ethylenebisacrylamide,ethylene bis acrylamide,n,n'-ethane-1,2-diyl diacrylamide,2-propenamide, n,n'-1,2-ethanediylbis,n,n'-bis acryloyl-1,2-diaminoethane,n,n'-bis acryloyl-1,2-diaminoethane, stabilized with hydroquinone,n-2-prop-2-enoylamino ethyl prop-2-enamide,n-2-prop-2-enamido ethyl prop-2-enamide,ethylenebisacrylamide |
| IUPAC Name | N-[2-(prop-2-enoylamino)ethyl]prop-2-enamide |
| InChI Key | AYGYHGXUJBFUJU-UHFFFAOYSA-N |
| Molecular Formula | C8H12N2O2 |
(-)-Epicatechin Gallate 98.0+%, TCI America™
CAS: 1257-08-5 Molecular Formula: C22H18O10 Molecular Weight (g/mol): 442.376 MDL Number: MFCD00075936 InChI Key: LSHVYAFMTMFKBA-TZIWHRDSSA-N Synonym: =--epicatechin gallate,epicatechin gallate,=--epicatechin-3-o-gallate,l-epicatechin gallate,=--epicatechin-3-gallate,=--epicatechingallate,epicatechin monogallate,--epicatechin 3-o-gallate,teatannin,epicatechol, gallate PubChem CID: 107905 ChEBI: CHEBI:70255 IUPAC Name: [(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-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)OC(=O)C4=CC(=C(C(=C4)O)O)O
| PubChem CID | 107905 |
|---|---|
| CAS | 1257-08-5 |
| Molecular Weight (g/mol) | 442.376 |
| ChEBI | CHEBI:70255 |
| MDL Number | MFCD00075936 |
| SMILES | C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O |
| Synonym | =--epicatechin gallate,epicatechin gallate,=--epicatechin-3-o-gallate,l-epicatechin gallate,=--epicatechin-3-gallate,=--epicatechingallate,epicatechin monogallate,--epicatechin 3-o-gallate,teatannin,epicatechol, gallate |
| IUPAC Name | [(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate |
| InChI Key | LSHVYAFMTMFKBA-TZIWHRDSSA-N |
| Molecular Formula | C22H18O10 |
Ethyl Formate 98.0+%, TCI America™
CAS: 109-94-4 Molecular Formula: C3H6O2 Molecular Weight (g/mol): 74.08 MDL Number: MFCD00003294 InChI Key: WBJINCZRORDGAQ-UHFFFAOYSA-N Synonym: areginal,formic acid, ethyl ester,ethyl methanoate,formic acid ethyl ester,aethylformiat,ethyl formic ester,ethylformate,ethylformiaat,formic ether,ethylformiat PubChem CID: 8025 ChEBI: CHEBI:52342 IUPAC Name: ethyl formate SMILES: CCOC=O
| PubChem CID | 8025 |
|---|---|
| CAS | 109-94-4 |
| Molecular Weight (g/mol) | 74.08 |
| ChEBI | CHEBI:52342 |
| MDL Number | MFCD00003294 |
| SMILES | CCOC=O |
| Synonym | areginal,formic acid, ethyl ester,ethyl methanoate,formic acid ethyl ester,aethylformiat,ethyl formic ester,ethylformate,ethylformiaat,formic ether,ethylformiat |
| IUPAC Name | ethyl formate |
| InChI Key | WBJINCZRORDGAQ-UHFFFAOYSA-N |
| Molecular Formula | C3H6O2 |
4-Acetamidopyridine 98.0+%, TCI America™
CAS: 5221-42-1 Molecular Formula: C7H8N2O Molecular Weight (g/mol): 136.154 InChI Key: BIJAWQUBRNHZGE-UHFFFAOYSA-N Synonym: N-(4-Pyridyl)acetamide PubChem CID: 21288 IUPAC Name: N-pyridin-4-ylacetamide SMILES: CC(=O)NC1=CC=NC=C1
| PubChem CID | 21288 |
|---|---|
| CAS | 5221-42-1 |
| Molecular Weight (g/mol) | 136.154 |
| SMILES | CC(=O)NC1=CC=NC=C1 |
| Synonym | N-(4-Pyridyl)acetamide |
| IUPAC Name | N-pyridin-4-ylacetamide |
| InChI Key | BIJAWQUBRNHZGE-UHFFFAOYSA-N |
| Molecular Formula | C7H8N2O |
Isopropyl Isobutyrate 98.0+%, TCI America™
CAS: 617-50-5 Molecular Formula: C7H14O2 Molecular Weight (g/mol): 130.19 MDL Number: MFCD00059365 InChI Key: WVRPFQGZHKZCEB-UHFFFAOYSA-N Synonym: Isobutyric Acid Isopropyl Ester PubChem CID: 12044 IUPAC Name: propan-2-yl 2-methylpropanoate SMILES: CC(C)OC(=O)C(C)C
| PubChem CID | 12044 |
|---|---|
| CAS | 617-50-5 |
| Molecular Weight (g/mol) | 130.19 |
| MDL Number | MFCD00059365 |
| SMILES | CC(C)OC(=O)C(C)C |
| Synonym | Isobutyric Acid Isopropyl Ester |
| IUPAC Name | propan-2-yl 2-methylpropanoate |
| InChI Key | WVRPFQGZHKZCEB-UHFFFAOYSA-N |
| Molecular Formula | C7H14O2 |
Methyl Isobutyrate 99.0+%, TCI America™
CAS: 547-63-7 Molecular Formula: C5H10O2 Molecular Weight (g/mol): 102.133 MDL Number: MFCD00008914 InChI Key: BHIWKHZACMWKOJ-UHFFFAOYSA-N Synonym: methyl isobutyrate,methyl 2-methylpropionate,methyl isobutanoate,propanoic acid, 2-methyl-, methyl ester,isobutyric acid, methyl ester,methylisobutyrate,isobutyric acid methyl ester,poly d-lactide,methyl isobutyrate natural,methylester kyseliny isomaselne PubChem CID: 11039 ChEBI: CHEBI:73689 IUPAC Name: methyl 2-methylpropanoate SMILES: CC(C)C(=O)OC
| PubChem CID | 11039 |
|---|---|
| CAS | 547-63-7 |
| Molecular Weight (g/mol) | 102.133 |
| ChEBI | CHEBI:73689 |
| MDL Number | MFCD00008914 |
| SMILES | CC(C)C(=O)OC |
| Synonym | methyl isobutyrate,methyl 2-methylpropionate,methyl isobutanoate,propanoic acid, 2-methyl-, methyl ester,isobutyric acid, methyl ester,methylisobutyrate,isobutyric acid methyl ester,poly d-lactide,methyl isobutyrate natural,methylester kyseliny isomaselne |
| IUPAC Name | methyl 2-methylpropanoate |
| InChI Key | BHIWKHZACMWKOJ-UHFFFAOYSA-N |
| Molecular Formula | C5H10O2 |
Allyl Acrylate (stabilized with MEHQ) 98.0+%, TCI America™
CAS: 999-55-3 Molecular Formula: C6H8O2 Molecular Weight (g/mol): 112.128 MDL Number: MFCD00014949 InChI Key: QTECDUFMBMSHKR-UHFFFAOYSA-N Synonym: allyl acrylate,acrylic acid, allyl ester,2-propenoic acid, 2-propenyl ester,unii-705ga5o3us,ccris 4745,acrylic acid allyl ester,2-propenoic acid, 2-propen-1-yl ester,allylacrylate,acrylic acid allyl,acmc-20alut PubChem CID: 13835 IUPAC Name: prop-2-enyl prop-2-enoate SMILES: C=CCOC(=O)C=C
| PubChem CID | 13835 |
|---|---|
| CAS | 999-55-3 |
| Molecular Weight (g/mol) | 112.128 |
| MDL Number | MFCD00014949 |
| SMILES | C=CCOC(=O)C=C |
| Synonym | allyl acrylate,acrylic acid, allyl ester,2-propenoic acid, 2-propenyl ester,unii-705ga5o3us,ccris 4745,acrylic acid allyl ester,2-propenoic acid, 2-propen-1-yl ester,allylacrylate,acrylic acid allyl,acmc-20alut |
| IUPAC Name | prop-2-enyl prop-2-enoate |
| InChI Key | QTECDUFMBMSHKR-UHFFFAOYSA-N |
| Molecular Formula | C6H8O2 |
Ethyl Valerate 98.0+%, TCI America™
CAS: 539-82-2 Molecular Formula: C7H14O2 Molecular Weight (g/mol): 130.187 MDL Number: MFCD00009479 InChI Key: ICMAFTSLXCXHRK-UHFFFAOYSA-N Synonym: ethyl valerate,ethyl n-valerate,pentanoic acid, ethyl ester,valeric acid, ethyl ester,ethylvalerate,ethyl valerianate,pentanoic acid ethyl ester,n-valeric acid ethyl ester,valeric acid, ethyl ester 8ci,fema no. 2462 PubChem CID: 10882 IUPAC Name: ethyl pentanoate SMILES: CCCCC(=O)OCC
| PubChem CID | 10882 |
|---|---|
| CAS | 539-82-2 |
| Molecular Weight (g/mol) | 130.187 |
| MDL Number | MFCD00009479 |
| SMILES | CCCCC(=O)OCC |
| Synonym | ethyl valerate,ethyl n-valerate,pentanoic acid, ethyl ester,valeric acid, ethyl ester,ethylvalerate,ethyl valerianate,pentanoic acid ethyl ester,n-valeric acid ethyl ester,valeric acid, ethyl ester 8ci,fema no. 2462 |
| IUPAC Name | ethyl pentanoate |
| InChI Key | ICMAFTSLXCXHRK-UHFFFAOYSA-N |
| Molecular Formula | C7H14O2 |
Methyl trans-2-Octenoate 95.0+%, TCI America™
CAS: 7367-81-9 Molecular Formula: C9H16O2 Molecular Weight (g/mol): 156.225 MDL Number: MFCD00036620 InChI Key: CJBQSBZJDJHMLF-BQYQJAHWSA-N Synonym: methyl trans-2-octenoate,methyl oct-2-enoate,methyl 2-octenoate,2-octenoic acid, methyl ester,methyl e-oct-2-enoate,unii-9en9v40j78,2-octenoic acid, methyl ester, e,2-octenoic acid, methyl ester, 2e,2-octenoic acid methyl ester,fema no. 3712 PubChem CID: 5364532 IUPAC Name: methyl (E)-oct-2-enoate SMILES: CCCCCC=CC(=O)OC
| PubChem CID | 5364532 |
|---|---|
| CAS | 7367-81-9 |
| Molecular Weight (g/mol) | 156.225 |
| MDL Number | MFCD00036620 |
| SMILES | CCCCCC=CC(=O)OC |
| Synonym | methyl trans-2-octenoate,methyl oct-2-enoate,methyl 2-octenoate,2-octenoic acid, methyl ester,methyl e-oct-2-enoate,unii-9en9v40j78,2-octenoic acid, methyl ester, e,2-octenoic acid, methyl ester, 2e,2-octenoic acid methyl ester,fema no. 3712 |
| IUPAC Name | methyl (E)-oct-2-enoate |
| InChI Key | CJBQSBZJDJHMLF-BQYQJAHWSA-N |
| Molecular Formula | C9H16O2 |
Ethyl 4-Nitrocinnamate 98.0+%, TCI America™
CAS: 953-26-4 Molecular Formula: C11H11NO4 Molecular Weight (g/mol): 221.212 MDL Number: MFCD00007380 InChI Key: PFBQVGXIMLXCQB-VMPITWQZSA-N Synonym: ethyl 4-nitrocinnamate,ethyl p-nitrocinnamate,ethyl 3-4-nitrophenyl acrylate,2-propenoic acid, 3-4-nitrophenyl-, ethyl ester,cinnamic acid, p-nitro-, ethyl ester,ethyl-4-nitrocinnamate,e-ethyl 3-4-nitrophenyl acrylate,propenoic acid, 3-4-nitrophenyl-, ethyl ester,4-nitrozimtsaeure-ethylester,ethyl 2e-3-4-nitrophenyl prop-2-enoate PubChem CID: 1268038 IUPAC Name: ethyl (E)-3-(4-nitrophenyl)prop-2-enoate SMILES: CCOC(=O)C=CC1=CC=C(C=C1)[N+](=O)[O-]
| PubChem CID | 1268038 |
|---|---|
| CAS | 953-26-4 |
| Molecular Weight (g/mol) | 221.212 |
| MDL Number | MFCD00007380 |
| SMILES | CCOC(=O)C=CC1=CC=C(C=C1)[N+](=O)[O-] |
| Synonym | ethyl 4-nitrocinnamate,ethyl p-nitrocinnamate,ethyl 3-4-nitrophenyl acrylate,2-propenoic acid, 3-4-nitrophenyl-, ethyl ester,cinnamic acid, p-nitro-, ethyl ester,ethyl-4-nitrocinnamate,e-ethyl 3-4-nitrophenyl acrylate,propenoic acid, 3-4-nitrophenyl-, ethyl ester,4-nitrozimtsaeure-ethylester,ethyl 2e-3-4-nitrophenyl prop-2-enoate |
| IUPAC Name | ethyl (E)-3-(4-nitrophenyl)prop-2-enoate |
| InChI Key | PFBQVGXIMLXCQB-VMPITWQZSA-N |
| Molecular Formula | C11H11NO4 |