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147253-69-8 | Phospholane, 1,1'-(1,2-phenylene)bis[2,5-bis(1-methylethyl)-, (2S,2'S,5S,5'S)-
CAS No: 147253-69-8 Catalog No: AG001EQR MDL No:
Product Description
Catalog Number:
AG001EQR
Chemical Name:
Phospholane, 1,1'-(1,2-phenylene)bis[2,5-bis(1-methylethyl)-, (2S,2'S,5S,5'S)-
CAS Number:
147253-69-8
Molecular Formula:
C26H44P2
Molecular Weight:
418.5751
IUPAC Name:
(2S,5S)-1-[2-[(2S,5S)-2,5-di(propan-2-yl)phospholan-1-yl]phenyl]-2,5-di(propan-2-yl)phospholane
InChI:
InChI=1S/C26H44P2/c1-17(2)21-13-14-22(18(3)4)27(21)25-11-9-10-12-26(25)28-23(19(5)6)15-16-24(28)20(7)8/h9-12,17-24H,13-16H2,1-8H3/t21-,22-,23-,24-/m0/s1
InChI Key:
RBVGOQHQBUPSGX-ZJZGAYNASA-N
SMILES:
CC([C@@H]1CC[C@H](P1c1ccccc1P1[C@@H](CC[C@H]1C(C)C)C(C)C)C(C)C)C
Properties
Complexity:
407
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
418.292g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
418.586g/mol
Monoisotopic Mass:
418.292g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.6
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