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Home > Pyridines > 485828-63-5
485828-63-5 | 1-(pyridin-4-yl)cyclobutane-1-carbonitrile
CAS No: 485828-63-5 Catalog No: AG01C4OI MDL No:MFCD11109793
Product Description
Catalog Number:
AG01C4OI
Chemical Name:
1-(pyridin-4-yl)cyclobutane-1-carbonitrile
CAS Number:
485828-63-5
Molecular Formula:
C10H10N2
Molecular Weight:
158.1998
MDL Number:
MFCD11109793
IUPAC Name:
1-pyridin-4-ylcyclobutane-1-carbonitrile
InChI:
InChI=1S/C10H10N2/c11-8-10(4-1-5-10)9-2-6-12-7-3-9/h2-3,6-7H,1,4-5H2
InChI Key:
TUGSUTQEUUQUKL-UHFFFAOYSA-N
SMILES:
N#CC1(CCC1)c1ccncc1
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.084g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.204g/mol
Monoisotopic Mass:
158.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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