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(2-Methoxyphenyl)diphenylbis(2,2,2-trifluoroethoxy)phosphorane

HCID 85529032
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Basic information

CAS
102040-44-8
Standard SMILES
COc1ccccc1P(OCC(F)(F)F)(OCC(F)(F)F)(c1ccccc1)c1ccccc1
InChIKey
BAOXQPYZGVFVPI-UHFFFAOYSA-N
Molecular formula
C23H21F6O3P
Average molar mass
490.4 g/mol
Monoisotopic mass
490.1132505

Names & identifiers

Preferred name
(2-Methoxyphenyl)diphenylbis(2,2,2-trifluoroethoxy)phosphorane
IUPAC
(2-methoxyphenyl)-diphenyl-bis(2,2,2-trifluoroethoxy)-λ5-phosphane

Names & synonyms

(2-Methoxyphenyl)diphenylbis(2,2,2-trifluoroethoxy)phosphoranePhosphorane, (2-methoxyphenyl)diphenylbis(2,2,2-trifluoroethoxy)-102040-44-8

Database identifiers

CAS
102040-44-8
PubChem CID
85529032
Nikkaji
J1.598.427I

Properties

Computed structural properties

XLogP
6.9
Topological polar surface area
27.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
9
Rotatable bonds
8
Heavy atoms
33
Formal charge
0
Complexity
574

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