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Home > Other Heterocycles > 87944-11-4
87944-11-4 | Phosphine oxide, bicyclo[4.1.0]hept-7-yldiphenyl-
CAS No: 87944-11-4 Catalog No: AG004D5M MDL No:
Product Description
Catalog Number:
AG004D5M
Chemical Name:
Phosphine oxide, bicyclo[4.1.0]hept-7-yldiphenyl-
CAS Number:
87944-11-4
Molecular Formula:
C19H21OP
Molecular Weight:
296.3432
IUPAC Name:
7-diphenylphosphorylbicyclo[4.1.0]heptane
InChI:
InChI=1S/C19H21OP/c20-21(15-9-3-1-4-10-15,16-11-5-2-6-12-16)19-17-13-7-8-14-18(17)19/h1-6,9-12,17-19H,7-8,13-14H2
InChI Key:
KSSRKFNAGACKNC-UHFFFAOYSA-N
SMILES:
O=P(c1ccccc1)(c1ccccc1)C1C2C1CCCC2
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.133g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
296.35g/mol
Monoisotopic Mass:
296.133g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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