Home Halogens 2-chloro-5-oxo-5,6,7,8-tetrahydroquinoline-3-carbonitrile

2-chloro-5-oxo-5,6,7,8-tetrahydroquinoline-3-carbonitrile

CAS No.:
864226-30-2
Catalog Number:
AG01DWQR
Molecular Formula:
C10H7ClN2O
Molecular Weight:
206.6284
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Product Description
Catalog Number:
AG01DWQR
Chemical Name:
2-chloro-5-oxo-5,6,7,8-tetrahydroquinoline-3-carbonitrile
CAS Number:
864226-30-2
Molecular Formula:
C10H7ClN2O
Molecular Weight:
206.6284
MDL Number:
MFCD18785329
IUPAC Name:
2-chloro-5-oxo-7,8-dihydro-6H-quinoline-3-carbonitrile
InChI:
InChI=1S/C10H7ClN2O/c11-10-6(5-12)4-7-8(13-10)2-1-3-9(7)14/h4H,1-3H2
InChI Key:
QCJHTNHNYABOAL-UHFFFAOYSA-N
SMILES:
N#Cc1cc2C(=O)CCCc2nc1Cl
Properties
Complexity:
296  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.025g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.629g/mol
Monoisotopic Mass:
206.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
53.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties