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1260763-18-5 | 1-(3-Iodophenyl)cyclohexanecarbonitrile
CAS No: 1260763-18-5 Catalog No: AG00HIUE MDL No:
Product Description
Catalog Number:
AG00HIUE
Chemical Name:
1-(3-Iodophenyl)cyclohexanecarbonitrile
CAS Number:
1260763-18-5
IUPAC Name:
1-(3-iodophenyl)cyclohexane-1-carbonitrile
InChI:
InChI=1S/C13H14IN/c14-12-6-4-5-11(9-12)13(10-15)7-2-1-3-8-13/h4-6,9H,1-3,7-8H2
InChI Key:
GOWYGYIYAUSSHS-UHFFFAOYSA-N
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.017g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
311.166g/mol
Monoisotopic Mass:
311.017g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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