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181950-55-0 | 7-Quinolinecarbonitrile, 4-chloro-
CAS No: 181950-55-0 Catalog No: AG002382 MDL No:MFCD08063186
Product Description
Catalog Number:
AG002382
Chemical Name:
7-Quinolinecarbonitrile, 4-chloro-
CAS Number:
181950-55-0
Molecular Formula:
C10H5ClN2
Molecular Weight:
188.6131
MDL Number:
MFCD08063186
IUPAC Name:
4-chloroquinoline-7-carbonitrile
InChI:
InChI=1S/C10H5ClN2/c11-9-3-4-13-10-5-7(6-12)1-2-8(9)10/h1-5H
InChI Key:
NFCSRTCOMSRFOC-UHFFFAOYSA-N
SMILES:
N#Cc1ccc2c(c1)nccc2Cl
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.014g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.614g/mol
Monoisotopic Mass:
188.014g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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