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490039-72-0 | 4-Iodonicotinonitrile
CAS No: 490039-72-0 Catalog No: AG006VYA MDL No:MFCD09037453
Product Description
Catalog Number:
AG006VYA
Chemical Name:
4-Iodonicotinonitrile
CAS Number:
490039-72-0
Molecular Formula:
C6H3IN2
Molecular Weight:
230.0059
MDL Number:
MFCD09037453
IUPAC Name:
4-iodopyridine-3-carbonitrile
InChI:
InChI=1S/C6H3IN2/c7-6-1-2-9-4-5(6)3-8/h1-2,4H
InChI Key:
CJKHIIQONPNAIP-UHFFFAOYSA-N
SMILES:
N#Cc1cnccc1I
Properties
Complexity:
137
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.934g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.008g/mol
Monoisotopic Mass:
229.934g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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