956191-52-9
[1,1'-Biphenyl]-2-carboxylic acid, 4'-(1H-pyrazol-1-ylmethyl)-
Name[1,1'-Biphenyl]-2-carboxylic acid, 4'-(1H-pyrazol-1-ylmethyl)-
1Identification
【Name】
[1,1'-Biphenyl]-2-carboxylic acid, 4'-(1H-pyrazol-1-ylmethyl)-
【CAS】
【MDL】
【English Synonyms】
【Formula】
C17H14N2O2
【MolWeight】
278.3053
【Inchi】
InChI=1S/C17H14N2O2/c20-17(21)16-5-2-1-4-15(16)14-8-6-13(7-9-14)12-19-11-3-10-18-19/h1-11H,12H2,(H,20,21)
【InChIKey】
InChIKey=AFXDJVZHRMHWLP-UHFFFAOYSA-N
【SMILES】
N1(N=CC=C1)CC1=CC=C(C=C1)C=1C(=CC=CC1)C(=O)O
【MOL File】
[1,1'-Biphenyl]-2-ca….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:0
XLogP3:0.0
Bulk/Fine:
3Material Safety Data Sheet(MSDS)
4CML File
[1,1'-Biphenyl]-2-carboxylic acid, 4'-(1H-pyrazol-1-ylmethyl)-.cml