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2973-27-5 | 4-Quinolinecarbonitrile
CAS No: 2973-27-5 Catalog No: AG002Z92 MDL No:MFCD00972111
Product Description
Catalog Number:
AG002Z92
Chemical Name:
4-Quinolinecarbonitrile
CAS Number:
2973-27-5
Molecular Formula:
C10H6N2
Molecular Weight:
154.1680
MDL Number:
MFCD00972111
IUPAC Name:
quinoline-4-carbonitrile
InChI:
InChI=1S/C10H6N2/c11-7-8-5-6-12-10-4-2-1-3-9(8)10/h1-6H
InChI Key:
JBSAUEMFOKUWTP-UHFFFAOYSA-N
SMILES:
N#Cc1ccnc2c1cccc2
NSC Number:
113049
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.053g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.172g/mol
Monoisotopic Mass:
154.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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