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10224-14-3 | Cyclopropanecarbonitrile, 1,2-diphenyl-
CAS No: 10224-14-3 Catalog No: AG00070E MDL No:
Product Description
Catalog Number:
AG00070E
Chemical Name:
Cyclopropanecarbonitrile, 1,2-diphenyl-
CAS Number:
10224-14-3
Molecular Formula:
C16H13N
Molecular Weight:
219.2811
IUPAC Name:
1,2-diphenylcyclopropane-1-carbonitrile
InChI:
InChI=1S/C16H13N/c17-12-16(14-9-5-2-6-10-14)11-15(16)13-7-3-1-4-8-13/h1-10,15H,11H2
InChI Key:
MIVVDTYTHSYGAF-UHFFFAOYSA-N
SMILES:
N#CC1(CC1c1ccccc1)c1ccccc1
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.105g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.287g/mol
Monoisotopic Mass:
219.105g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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