Home Nitriles 1-(6-Chloropyridin-3-yl)cyclobutanecarbonitrile

1-(6-Chloropyridin-3-yl)cyclobutanecarbonitrile

CAS No.:
485828-75-9
Catalog Number:
AG00E7EG
Molecular Formula:
C10H9ClN2
Molecular Weight:
192.6449
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Product Description
Catalog Number:
AG00E7EG
Chemical Name:
1-(6-Chloropyridin-3-yl)cyclobutanecarbonitrile
CAS Number:
485828-75-9
Molecular Formula:
C10H9ClN2
Molecular Weight:
192.6449
MDL Number:
MFCD24387481
IUPAC Name:
1-(6-chloropyridin-3-yl)cyclobutane-1-carbonitrile
InChI:
InChI=1S/C10H9ClN2/c11-9-3-2-8(6-13-9)10(7-12)4-1-5-10/h2-3,6H,1,4-5H2
InChI Key:
ISMOOOHNYQPYDE-UHFFFAOYSA-N
SMILES:
N#CC1(CCC1)c1ccc(nc1)Cl
Properties
Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.045g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.646g/mol
Monoisotopic Mass:
192.045g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties