Organic acids and derivatives
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3-(Methoxycarbonyl)phenylboronic Acid (contains varying amounts of Anhydride), TCI America™
CAS: 99769-19-4 Molecular Formula: C8H9BO4 Molecular Weight (g/mol): 179.97 MDL Number: MFCD02093046 InChI Key: ALTLCJHSJMGSLT-UHFFFAOYSA-N Synonym: 3-methoxycarbonyl phenylboronic acid,3-methoxycarbonylphenyl boronic acid,3-methoxycarbonyl phenyl boronic acid,3-methoxycarbonyl benzeneboronic acid,3-methoxycarbonylphenylbaronic acid,methyl 3-dihydroxyboranyl benzoate,m-methoxycarbonyl phenylboronic acid,3-carbomethoxy-phenylboronic acid PubChem CID: 2734714 IUPAC Name: [3-(methoxycarbonyl)phenyl]boronic acid SMILES: COC(=O)C1=CC=CC(=C1)B(O)O
| PubChem CID | 2734714 |
|---|---|
| CAS | 99769-19-4 |
| Molecular Weight (g/mol) | 179.97 |
| MDL Number | MFCD02093046 |
| SMILES | COC(=O)C1=CC=CC(=C1)B(O)O |
| Synonym | 3-methoxycarbonyl phenylboronic acid,3-methoxycarbonylphenyl boronic acid,3-methoxycarbonyl phenyl boronic acid,3-methoxycarbonyl benzeneboronic acid,3-methoxycarbonylphenylbaronic acid,methyl 3-dihydroxyboranyl benzoate,m-methoxycarbonyl phenylboronic acid,3-carbomethoxy-phenylboronic acid |
| IUPAC Name | [3-(methoxycarbonyl)phenyl]boronic acid |
| InChI Key | ALTLCJHSJMGSLT-UHFFFAOYSA-N |
| Molecular Formula | C8H9BO4 |
Fasudil Hydrochloride 98.0+%, TCI America™
CAS: 105628-07-7 Molecular Formula: C14H18ClN3O2S Molecular Weight (g/mol): 327.827 MDL Number: MFCD00943198 InChI Key: LFVPBERIVUNMGV-UHFFFAOYSA-N Synonym: fasudil hydrochloride,fasudil hcl,eril,at 877 hydrochloride,fasudil monohydrochloride,ha 1077 hydrochloride,unii-sq04n8s7br,5-1,4-diazepan-1-yl sulfonyl isoquinoline hydrochloride,sq04n8s7br PubChem CID: 163751 IUPAC Name: 5-(1,4-diazepan-1-ylsulfonyl)isoquinoline;hydrochloride SMILES: C1CNCCN(C1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3.Cl
| PubChem CID | 163751 |
|---|---|
| CAS | 105628-07-7 |
| Molecular Weight (g/mol) | 327.827 |
| MDL Number | MFCD00943198 |
| SMILES | C1CNCCN(C1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3.Cl |
| Synonym | fasudil hydrochloride,fasudil hcl,eril,at 877 hydrochloride,fasudil monohydrochloride,ha 1077 hydrochloride,unii-sq04n8s7br,5-1,4-diazepan-1-yl sulfonyl isoquinoline hydrochloride,sq04n8s7br |
| IUPAC Name | 5-(1,4-diazepan-1-ylsulfonyl)isoquinoline;hydrochloride |
| InChI Key | LFVPBERIVUNMGV-UHFFFAOYSA-N |
| Molecular Formula | C14H18ClN3O2S |
Vinyl Decanoate (stabilized with MEHQ) 99.0+%, TCI America™
CAS: 4704-31-8 Molecular Formula: C12H22O2 Molecular Weight (g/mol): 198.306 MDL Number: MFCD00027349 InChI Key: CMDXMIHZUJPRHG-UHFFFAOYSA-N Synonym: vinyl decanoate,decanoic acid, vinyl ester,vinyl n-decanoate,unii-ff00i399li,decanoic acid, ethenyl ester,n-capric acid vinyl ester,decanoic acid vinyl,acmc-1aqz4,decanoic acid vinyl ester,capric acid vinyl ester = vinyl decenoate PubChem CID: 62140 IUPAC Name: ethenyl decanoate SMILES: CCCCCCCCCC(=O)OC=C
| PubChem CID | 62140 |
|---|---|
| CAS | 4704-31-8 |
| Molecular Weight (g/mol) | 198.306 |
| MDL Number | MFCD00027349 |
| SMILES | CCCCCCCCCC(=O)OC=C |
| Synonym | vinyl decanoate,decanoic acid, vinyl ester,vinyl n-decanoate,unii-ff00i399li,decanoic acid, ethenyl ester,n-capric acid vinyl ester,decanoic acid vinyl,acmc-1aqz4,decanoic acid vinyl ester,capric acid vinyl ester = vinyl decenoate |
| IUPAC Name | ethenyl decanoate |
| InChI Key | CMDXMIHZUJPRHG-UHFFFAOYSA-N |
| Molecular Formula | C12H22O2 |
(-)-Diacetyl-L-tartaric Acid 98.0+%, TCI America™
CAS: 51591-38-9 Molecular Formula: C8H10O8 Molecular Weight (g/mol): 234.16 MDL Number: MFCD00070579 InChI Key: DNISEZBAYYIQFB-PHDIDXHHSA-N PubChem CID: 2060943 IUPAC Name: (2R,3R)-2,3-diacetyloxybutanedioic acid SMILES: CC(=O)OC(C(C(=O)O)OC(=O)C)C(=O)O
| PubChem CID | 2060943 |
|---|---|
| CAS | 51591-38-9 |
| Molecular Weight (g/mol) | 234.16 |
| MDL Number | MFCD00070579 |
| SMILES | CC(=O)OC(C(C(=O)O)OC(=O)C)C(=O)O |
| IUPAC Name | (2R,3R)-2,3-diacetyloxybutanedioic acid |
| InChI Key | DNISEZBAYYIQFB-PHDIDXHHSA-N |
| Molecular Formula | C8H10O8 |
Allyl Cyclohexanepropionate 98.0+%, TCI America™
CAS: 2705-87-5 Molecular Formula: C12H20O2 Molecular Weight (g/mol): 196.29 MDL Number: MFCD00059557 InChI Key: TWXUTZNBHUWMKJ-UHFFFAOYSA-N Synonym: Cyclohexanepropionic Acid Allyl Ester, 3-Cyclohexylpropionic Acid Allyl Ester PubChem CID: 17617 ChEBI: CHEBI:31188 IUPAC Name: prop-2-enyl 3-cyclohexylpropanoate SMILES: C=CCOC(=O)CCC1CCCCC1
| PubChem CID | 17617 |
|---|---|
| CAS | 2705-87-5 |
| Molecular Weight (g/mol) | 196.29 |
| ChEBI | CHEBI:31188 |
| MDL Number | MFCD00059557 |
| SMILES | C=CCOC(=O)CCC1CCCCC1 |
| Synonym | Cyclohexanepropionic Acid Allyl Ester, 3-Cyclohexylpropionic Acid Allyl Ester |
| IUPAC Name | prop-2-enyl 3-cyclohexylpropanoate |
| InChI Key | TWXUTZNBHUWMKJ-UHFFFAOYSA-N |
| Molecular Formula | C12H20O2 |
Butyl Decanoate 98.0+%, TCI America™
CAS: 30673-36-0 Molecular Formula: C14H28O2 Molecular Weight (g/mol): 228.376 MDL Number: MFCD00053823 InChI Key: ZRNCNTSXSYXHOW-UHFFFAOYSA-N Synonym: Decanoic Acid Butyl Ester PubChem CID: 35408 IUPAC Name: butyl decanoate SMILES: CCCCCCCCCC(=O)OCCCC
| PubChem CID | 35408 |
|---|---|
| CAS | 30673-36-0 |
| Molecular Weight (g/mol) | 228.376 |
| MDL Number | MFCD00053823 |
| SMILES | CCCCCCCCCC(=O)OCCCC |
| Synonym | Decanoic Acid Butyl Ester |
| IUPAC Name | butyl decanoate |
| InChI Key | ZRNCNTSXSYXHOW-UHFFFAOYSA-N |
| Molecular Formula | C14H28O2 |
N-Ethylsuccinimide 98.0+%, TCI America™
CAS: 2314-78-5 Molecular Formula: C6H9NO2 Molecular Weight (g/mol): 127.143 MDL Number: MFCD00059748 InChI Key: GHAZCVNUKKZTLG-UHFFFAOYSA-N PubChem CID: 16842 ChEBI: CHEBI:44348 IUPAC Name: 1-ethylpyrrolidine-2,5-dione SMILES: CCN1C(=O)CCC1=O
| PubChem CID | 16842 |
|---|---|
| CAS | 2314-78-5 |
| Molecular Weight (g/mol) | 127.143 |
| ChEBI | CHEBI:44348 |
| MDL Number | MFCD00059748 |
| SMILES | CCN1C(=O)CCC1=O |
| IUPAC Name | 1-ethylpyrrolidine-2,5-dione |
| InChI Key | GHAZCVNUKKZTLG-UHFFFAOYSA-N |
| Molecular Formula | C6H9NO2 |
Methyl 4-(Aminomethyl)cyclohexanecarboxylate Hydrochloride (cis- and trans- mixture) 98.0+%, TCI America™
CAS: 54640-02-7 Molecular Formula: C9H18ClNO2 Molecular Weight (g/mol): 207.698 MDL Number: MFCD03093748 InChI Key: PZPSRTWFJCGJLP-UHFFFAOYSA-N Synonym: 4-(Aminomethyl)cyclohexanecarboxylic Acid Methyl Ester Hydrochloride PubChem CID: 12721445 IUPAC Name: methyl 4-(aminomethyl)cyclohexane-1-carboxylate;hydrochloride SMILES: COC(=O)C1CCC(CC1)CN.Cl
| PubChem CID | 12721445 |
|---|---|
| CAS | 54640-02-7 |
| Molecular Weight (g/mol) | 207.698 |
| MDL Number | MFCD03093748 |
| SMILES | COC(=O)C1CCC(CC1)CN.Cl |
| Synonym | 4-(Aminomethyl)cyclohexanecarboxylic Acid Methyl Ester Hydrochloride |
| IUPAC Name | methyl 4-(aminomethyl)cyclohexane-1-carboxylate;hydrochloride |
| InChI Key | PZPSRTWFJCGJLP-UHFFFAOYSA-N |
| Molecular Formula | C9H18ClNO2 |
(R)-(+)-2-(Methoxymethyl)-1-pyrrolidinecarboxaldehyde 98.0+%, TCI America™
CAS: 121817-71-8 Molecular Formula: C7H13NO2 Molecular Weight (g/mol): 143.186 MDL Number: MFCD00191670 InChI Key: JNIOQRWRORXADR-SSDOTTSWSA-N Synonym: (R)-(+)-1-Formyl-2-(methoxymethyl)pyrrolidine PubChem CID: 12349568 IUPAC Name: (2R)-2-(methoxymethyl)pyrrolidine-1-carbaldehyde SMILES: COCC1CCCN1C=O
| PubChem CID | 12349568 |
|---|---|
| CAS | 121817-71-8 |
| Molecular Weight (g/mol) | 143.186 |
| MDL Number | MFCD00191670 |
| SMILES | COCC1CCCN1C=O |
| Synonym | (R)-(+)-1-Formyl-2-(methoxymethyl)pyrrolidine |
| IUPAC Name | (2R)-2-(methoxymethyl)pyrrolidine-1-carbaldehyde |
| InChI Key | JNIOQRWRORXADR-SSDOTTSWSA-N |
| Molecular Formula | C7H13NO2 |
3,5-Dimethoxyphenylboronic Acid (contains varying amounts of Anhydride), TCI America™
CAS: 192182-54-0 Molecular Formula: C8H11BO4 Molecular Weight (g/mol): 181.982 MDL Number: MFCD03095127 InChI Key: XUIURRYWQBBCCK-UHFFFAOYSA-N PubChem CID: 4374257 IUPAC Name: (3,5-dimethoxyphenyl)boronic acid SMILES: B(C1=CC(=CC(=C1)OC)OC)(O)O
| PubChem CID | 4374257 |
|---|---|
| CAS | 192182-54-0 |
| Molecular Weight (g/mol) | 181.982 |
| MDL Number | MFCD03095127 |
| SMILES | B(C1=CC(=CC(=C1)OC)OC)(O)O |
| IUPAC Name | (3,5-dimethoxyphenyl)boronic acid |
| InChI Key | XUIURRYWQBBCCK-UHFFFAOYSA-N |
| Molecular Formula | C8H11BO4 |
(R)-(+)-2-Bromopropionic Acid 98.0+%, TCI America™
CAS: 10009-70-8 Molecular Formula: C3H5BrO2 Molecular Weight (g/mol): 152.975 MDL Number: MFCD00145205 InChI Key: MONMFXREYOKQTI-UWTATZPHSA-N PubChem CID: 6992152 IUPAC Name: (2R)-2-bromopropanoic acid SMILES: CC(C(=O)O)Br
| PubChem CID | 6992152 |
|---|---|
| CAS | 10009-70-8 |
| Molecular Weight (g/mol) | 152.975 |
| MDL Number | MFCD00145205 |
| SMILES | CC(C(=O)O)Br |
| IUPAC Name | (2R)-2-bromopropanoic acid |
| InChI Key | MONMFXREYOKQTI-UWTATZPHSA-N |
| Molecular Formula | C3H5BrO2 |
Ethyl (R)-(-)-4-Cyano-3-hydroxybutyrate 97.0+%, TCI America™
CAS: 141942-85-0 Molecular Formula: C7H11NO3 Molecular Weight (g/mol): 157.17 MDL Number: MFCD00270839 InChI Key: LOQFROBMBSKWQY-ZCFIWIBFSA-N Synonym: ethyl r---4-cyano-3-hydroxybutyate,ethyl r---4-cyano-3-hydroxybutyrate,ethyl 3r-4-cyano-3-hydroxybutanoate,r-4-cyano-3-hydroxybutyric acid ethyl ester,r-ethyl 4-cyano-3-hydroxybutyrate,ethyl-r-+-4-cyano-3-hydroxybutanoate,ethyl r-4-cyano-3-hydroxybutyrate,r-ethyl 4-cyano-3-hydroxybutanoate,r-4-cyano-3-hydroxy-butyric acid ethyl ester,r---4-cyano-3-hydroxybutyric acid ethyl ester PubChem CID: 2733879 IUPAC Name: ethyl (3R)-4-cyano-3-hydroxybutanoate SMILES: CCOC(=O)C[C@H](O)CC#N
| PubChem CID | 2733879 |
|---|---|
| CAS | 141942-85-0 |
| Molecular Weight (g/mol) | 157.17 |
| MDL Number | MFCD00270839 |
| SMILES | CCOC(=O)C[C@H](O)CC#N |
| Synonym | ethyl r---4-cyano-3-hydroxybutyate,ethyl r---4-cyano-3-hydroxybutyrate,ethyl 3r-4-cyano-3-hydroxybutanoate,r-4-cyano-3-hydroxybutyric acid ethyl ester,r-ethyl 4-cyano-3-hydroxybutyrate,ethyl-r-+-4-cyano-3-hydroxybutanoate,ethyl r-4-cyano-3-hydroxybutyrate,r-ethyl 4-cyano-3-hydroxybutanoate,r-4-cyano-3-hydroxy-butyric acid ethyl ester,r---4-cyano-3-hydroxybutyric acid ethyl ester |
| IUPAC Name | ethyl (3R)-4-cyano-3-hydroxybutanoate |
| InChI Key | LOQFROBMBSKWQY-ZCFIWIBFSA-N |
| Molecular Formula | C7H11NO3 |
Sodium Pyruvate 97.0+%, TCI America™
CAS: 113-24-6 Molecular Formula: C3H3NaO3 Molecular Weight (g/mol): 110.044 MDL Number: MFCD00002586 InChI Key: DAEPDZWVDSPTHF-UHFFFAOYSA-M Synonym: sodium pyruvate,pyruvic acid sodium salt,sodium 2-oxopropanoate,pyruvic acid, sodium salt,propanoic acid, 2-oxo-, sodium salt,sodium alpha-ketopropionate,pyruvate sodium,unii-pod38aif08,2-oxopropanoic acid sodium salt,pod38aif08 PubChem CID: 23662274 ChEBI: CHEBI:50144 IUPAC Name: sodium;2-oxopropanoate SMILES: CC(=O)C(=O)[O-].[Na+]
| PubChem CID | 23662274 |
|---|---|
| CAS | 113-24-6 |
| Molecular Weight (g/mol) | 110.044 |
| ChEBI | CHEBI:50144 |
| MDL Number | MFCD00002586 |
| SMILES | CC(=O)C(=O)[O-].[Na+] |
| Synonym | sodium pyruvate,pyruvic acid sodium salt,sodium 2-oxopropanoate,pyruvic acid, sodium salt,propanoic acid, 2-oxo-, sodium salt,sodium alpha-ketopropionate,pyruvate sodium,unii-pod38aif08,2-oxopropanoic acid sodium salt,pod38aif08 |
| IUPAC Name | sodium;2-oxopropanoate |
| InChI Key | DAEPDZWVDSPTHF-UHFFFAOYSA-M |
| Molecular Formula | C3H3NaO3 |
2-Aminobenzenesulfonic Acid 99.0+%, TCI America™
CAS: 88-21-1 Molecular Formula: C6H7NO3S Molecular Weight (g/mol): 173.186 MDL Number: MFCD00007705 InChI Key: ZMCHBSMFKQYNKA-UHFFFAOYSA-N Synonym: orthanilic acid,aniline-2-sulfonic acid,o-aminobenzenesulfonic acid,o-sulfanilic acid,aniline-o-sulfonic acid,2-sulfanilic acid,aniline-o-sulphonic acid,1-aminobenzene-2-sulfonic acid,2-aminobenzenesulphonic acid,benzenesulfonic acid, 2-amino PubChem CID: 6926 ChEBI: CHEBI:1015 IUPAC Name: 2-aminobenzenesulfonic acid SMILES: C1=CC=C(C(=C1)N)S(=O)(=O)O
| PubChem CID | 6926 |
|---|---|
| CAS | 88-21-1 |
| Molecular Weight (g/mol) | 173.186 |
| ChEBI | CHEBI:1015 |
| MDL Number | MFCD00007705 |
| SMILES | C1=CC=C(C(=C1)N)S(=O)(=O)O |
| Synonym | orthanilic acid,aniline-2-sulfonic acid,o-aminobenzenesulfonic acid,o-sulfanilic acid,aniline-o-sulfonic acid,2-sulfanilic acid,aniline-o-sulphonic acid,1-aminobenzene-2-sulfonic acid,2-aminobenzenesulphonic acid,benzenesulfonic acid, 2-amino |
| IUPAC Name | 2-aminobenzenesulfonic acid |
| InChI Key | ZMCHBSMFKQYNKA-UHFFFAOYSA-N |
| Molecular Formula | C6H7NO3S |
4-Isobutylcyclohexanecarboxylic Acid (cis- and trans- mixture) 98.0+%, TCI America™
CAS: 38792-88-0 Molecular Formula: C11H20O2 Molecular Weight (g/mol): 184.279 InChI Key: NFJJRCCYQXONBL-UHFFFAOYSA-N PubChem CID: 217396 IUPAC Name: 4-(2-methylpropyl)cyclohexane-1-carboxylic acid SMILES: CC(C)CC1CCC(CC1)C(=O)O
| PubChem CID | 217396 |
|---|---|
| CAS | 38792-88-0 |
| Molecular Weight (g/mol) | 184.279 |
| SMILES | CC(C)CC1CCC(CC1)C(=O)O |
| IUPAC Name | 4-(2-methylpropyl)cyclohexane-1-carboxylic acid |
| InChI Key | NFJJRCCYQXONBL-UHFFFAOYSA-N |
| Molecular Formula | C11H20O2 |