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Home > Other Heterocycles > 189210-88-6
189210-88-6 | 7-Phosphabicyclo[2.2.1]heptane, 2,5-dimethyl-7-phenyl-, (1R,2S,4R,5S)-
CAS No: 189210-88-6 Catalog No: AG002I32 MDL No:
Product Description
Catalog Number:
AG002I32
Chemical Name:
7-Phosphabicyclo[2.2.1]heptane, 2,5-dimethyl-7-phenyl-, (1R,2S,4R,5S)-
CAS Number:
189210-88-6
Molecular Formula:
C14H19P
Molecular Weight:
218.2744
IUPAC Name:
(1R,2S,4R,5S)-2,5-dimethyl-7-phenyl-7-phosphabicyclo[2.2.1]heptane
InChI:
InChI=1S/C14H19P/c1-10-8-14-11(2)9-13(10)15(14)12-6-4-3-5-7-12/h3-7,10-11,13-14H,8-9H2,1-2H3/t10-,11-,13+,14+/m0/s1
InChI Key:
LUEHQOLJQPSOSN-CDGCEXEKSA-N
SMILES:
C[C@H]1C[C@H]2P([C@@H]1C[C@@H]2C)c1ccccc1
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
218.122g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.28g/mol
Monoisotopic Mass:
218.122g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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