| CAS Number | 1258609-39-0 |
| Catalog Number | AG000OU1(AGN-PC-0J2C28) |
| Chemical Name | 3-(4-Aminophenyl)pyridine-2-carboxylic acid |
| IUPAC Name | 3-(4-aminophenyl)pyridine-2-carboxylic acid |
| InChI | InChI=1S/C12H10N2O2/c13-9-5-3-8(4-6-9)10-2-1-7-14-11(10)12(15)16/h1-7H,13H2,(H,15,16) |
| InChI Key | WDUQFUWQSSRRDB-UHFFFAOYSA-N |
| MDL Number | MFCD18085814 |
| Molecular Formula | C12H10N2O2 |
| Molecular Weight | 214.2200 |
| SMILES | Nc1ccc(cc1)c1cccnc1C(=O)O |
| Synonyms | 3-(4-Aminophenyl)pyridine-2-carboxylic acid,
1258609-39-0,
ACMC-209b0s,
CTK8A9596,
DTXSID90742689,
ANW-18554,
MFCD18085814,
ZINC85472236,
TC-107299,
Z9007,
2-Pyridinecarboxylic acid, 3-(4-aminophenyl)-,
C12H10N2O2,
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| Complexity | 249 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 214.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 214.224g/mol |
| Monoisotopic Mass | 214.074g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 76.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number