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77876-39-2 | (2S,4S)-Pentane-2,4-diylbis(diphenylphosphine)
CAS No: 77876-39-2 Catalog No: AG003BPI MDL No:MFCD00058923
Product Description
Catalog Number:
AG003BPI
Chemical Name:
(2S,4S)-Pentane-2,4-diylbis(diphenylphosphine)
CAS Number:
77876-39-2
Molecular Formula:
C29H30P2
Molecular Weight:
440.4960
MDL Number:
MFCD00058923
IUPAC Name:
[(2S,4S)-4-diphenylphosphanylpentan-2-yl]-diphenylphosphane
InChI:
InChI=1S/C29H30P2/c1-24(30(26-15-7-3-8-16-26)27-17-9-4-10-18-27)23-25(2)31(28-19-11-5-12-20-28)29-21-13-6-14-22-29/h3-22,24-25H,23H2,1-2H3/t24-,25-/m0/s1
InChI Key:
CTYPJIUQROQJBG-DQEYMECFSA-N
SMILES:
C[C@H](P(c1ccccc1)c1ccccc1)C[C@@H](P(c1ccccc1)c1ccccc1)C
Properties
Complexity:
401
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
440.182g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
440.507g/mol
Monoisotopic Mass:
440.182g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.1
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