Molecule

ID:135621

General Information
Structure
MolImage
Molecular Formula
C₃₃H₄₉AuClP
Molecular Mass
709.135471
Exact Mass
708.29260888
Charge
0
InChI
InChI=1S/C33H49P.Au.ClH/c1-23(2)26-21-30(24(3)4)33(31(22-26)25(5)6)29-19-13-14-20-32(29)34(27-15-9-7-10-16-27)28-17-11-8-12-18-28;;/h13-14,19-25,27-28H,7-12,15-18H2,1-6H3;;1H/q;+1;/p-1
InChIKey
AFVLNRJUCUDBHP-UHFFFAOYSA-M
Canonic Smiles
CC(c1cc(cc(c1c1ccccc1P(C1CCCCC1)C1CCCCC1)C(C)C)C(C)C)C.Cl[Au]
Isomeric Smiles
CC(C)c1cc(c(c(c1)C(C)C)c1ccccc1P(C1CCCCC1)C1CCCCC1)C(C)C.Cl[Au]
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
10.071707
LogD (pH = 7.4)
10.197986
Log P
10.3948
Molar Refractivity
151.7063
Polarizability
61.180626
Polar Surface Area
0.0
Rotatable Bonds
6
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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CAS 854045-94-6|2-二环己基膦基-2′,4′,6′-三异丙基联苯基氯化金(I)|chlorogold; dicyclohexyl({2-[2,4,6-tris(propan-2-yl)phenyl]phenyl})phosphane|2-Dicyclohexylphosphino-2′,4′,6′-triisopropylbiphen... | Molfinder