1255637-06-9
2-(4-CYANOPHENYL)ISONICOTINIC ACID
Name
2-(4-CYANOPHENYL)ISONICOTINIC ACID
Formula
C13 H8 N2 O2
MolWeight
224.218
1Identification
【Name】
2-(4-CYANOPHENYL)ISONICOTINIC ACID
【CAS】
【MDL】
MFCD17079047
【English Synonyms】
【Formula】
C13 H8 N2 O2
【MolWeight】
224.218
【Inchi】
InChI=1S/C13H8N2O2/c14-8-9-1-3-10(4-2-9)12-7-11(13(16)17)5-6-15-12/h1-7H,(H,16,17)
【InChIKey】
InChIKey=AMVOHNYZDRUSSS-UHFFFAOYSA-N
【SMILES】
c1cc(ccc1C#N)c2cc(ccn2)C(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:1.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
2-(4-CYANOPHENYL)ISONICOTINIC ACID.cml
Quick Release
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Country/Region:China
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