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Home > Other Heterocycles > 89032-34-8
89032-34-8 | Ethanone, 2-[4,6-bis(methylene)bicyclo[3.1.0]hex-2-yl]-1-phenyl-
CAS No: 89032-34-8 Catalog No: AG0043YI MDL No:
Product Description
Catalog Number:
AG0043YI
Chemical Name:
Ethanone, 2-[4,6-bis(methylene)bicyclo[3.1.0]hex-2-yl]-1-phenyl-
CAS Number:
89032-34-8
Molecular Formula:
C16H16O
Molecular Weight:
224.2976
IUPAC Name:
2-(4,6-dimethylidene-2-bicyclo[3.1.0]hexanyl)-1-phenylethanone
InChI:
InChI=1S/C16H16O/c1-10-8-13(16-11(2)15(10)16)9-14(17)12-6-4-3-5-7-12/h3-7,13,15-16H,1-2,8-9H2
InChI Key:
SOAOGSNXIWJCHB-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)CC1CC(=C)C2C1C2=C
Properties
Complexity:
373
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.12g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.303g/mol
Monoisotopic Mass:
224.12g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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