| CAS Number | 887983-38-2 |
| Catalog Number | AG004ARL(AGN-PC-04Q6LH) |
| Chemical Name | 6-(2-Methylphenyl)picolinic acid |
| IUPAC Name | 6-(2-methylphenyl)pyridine-2-carboxylic acid |
| InChI | InChI=1S/C13H11NO2/c1-9-5-2-3-6-10(9)11-7-4-8-12(14-11)13(15)16/h2-8H,1H3,(H,15,16) |
| InChI Key | XWXIZKKZMJFOMM-UHFFFAOYSA-N |
| MDL Number | MFCD06410063 |
| Molecular Formula | C13H11NO2 |
| Molecular Weight | 213.2319 |
| SMILES | C1=C(C2C(C)=CC=CC=2)N=C(C=C1)C(O)=O |
| Synonyms | 887983-38-2,
6-(o-Tolyl)picolinic acid,
6-(2-Methylphenyl)pyridine-2-carboxylic acid,
6-(2-METHYLPHENYL)PICOLINIC ACID,
CTK3E7175,
KS-00003TJA,
DTXSID20647072,
KM2777,
MFCD06410063,
ZINC39927827,
AKOS016013270,
AB23972,
TS-03033,
AJ-100618,
AX8249974,
V8731,
6-O-TOLYL-PYRIDINE-2-CARBOXYLIC ACID,
2-Pyridinecarboxylicacid, 6-(2-methylphenyl)-,
6-(o-Tolyl)picolinicacid,
C13H11NO2,
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| Complexity | 254 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 213.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 213.236g/mol |
| Monoisotopic Mass | 213.079g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 50.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number