Home Halogens 3-chloro-5H,6H,7H-cyclopenta[c]pyridine-4-carbonitrile

3-chloro-5H,6H,7H-cyclopenta[c]pyridine-4-carbonitrile

CAS No.:
103589-67-9
Catalog Number:
AG01BDOD
Molecular Formula:
C9H7ClN2
Molecular Weight:
178.6183
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Product Description
Catalog Number:
AG01BDOD
Chemical Name:
3-chloro-5H,6H,7H-cyclopenta[c]pyridine-4-carbonitrile
CAS Number:
103589-67-9
Molecular Formula:
C9H7ClN2
Molecular Weight:
178.6183
MDL Number:
MFCD19690416
IUPAC Name:
3-chloro-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile
InChI:
InChI=1S/C9H7ClN2/c10-9-8(4-11)7-3-1-2-6(7)5-12-9/h5H,1-3H2
InChI Key:
FLEGGCQGXMOSQW-UHFFFAOYSA-N
SMILES:
N#Cc1c(Cl)ncc2c1CCC2
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.03g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.619g/mol
Monoisotopic Mass:
178.03g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties