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1197237-84-5 | 2'-Aminobiphenyl-3-carbonitrile hydrochloride
CAS No: 1197237-84-5 Catalog No: AG01FA92 MDL No:
Product Description
Catalog Number:
AG01FA92
Chemical Name:
2'-Aminobiphenyl-3-carbonitrile hydrochloride
CAS Number:
1197237-84-5
Molecular Formula:
C13H11ClN2
Molecular Weight:
230.6928
IUPAC Name:
3-(2-aminophenyl)benzonitrile;hydrochloride
InChI:
InChI=1S/C13H10N2.ClH/c14-9-10-4-3-5-11(8-10)12-6-1-2-7-13(12)15;/h1-8H,15H2;1H
InChI Key:
TXROKWXVVFVTDC-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(c1)c1ccccc1N.Cl
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.061g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
230.695g/mol
Monoisotopic Mass:
230.061g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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