944344-46-1
4-(6-METHYLPYRIDIN-2-YL)BENZOIC ACID HYDROCHLORIDE
Name4-(6-METHYLPYRIDIN-2-YL)BENZOIC ACID HYDROCHLORIDE
FormulaC13 H11 N O2 . Cl H
1Identification
【Name】
4-(6-METHYLPYRIDIN-2-YL)BENZOIC ACID HYDROCHLORIDE
【CAS】
【MDL】
MFCD15528056
【English Synonyms】
【Formula】
C13 H11 N O2 . Cl H
【MolWeight】
249.696
【Inchi】
InChI=1S/C13H11NO2.ClH/c1-9-3-2-4-12(14-9)10-5-7-11(8-6-10)13(15)16;/h2-8H,1H3,(H,15,16);1H
【InChIKey】
InChIKey=CUJIHLHDNDCCAB-UHFFFAOYSA-N
【SMILES】
Cc1cccc(n1)c2ccc(cc2)C(=O)O.Cl
【MOL File】
4-(6-METHYLPYRIDIN-2….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(6-METHYLPYRIDIN-2-YL)BENZOIC ACID HYDROCHLORIDE.cml