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100204-54-4 | Ethanol, 1,1'-(phenylphosphinidene)bis[2,2,2-trichloro-
CAS No: 100204-54-4 Catalog No: AG00018U MDL No:
Product Description
Catalog Number:
AG00018U
Chemical Name:
Ethanol, 1,1'-(phenylphosphinidene)bis[2,2,2-trichloro-
CAS Number:
100204-54-4
Molecular Formula:
C10H9Cl6O2P
Molecular Weight:
404.8690
IUPAC Name:
2,2,2-trichloro-1-[phenyl-(2,2,2-trichloro-1-hydroxyethyl)phosphanyl]ethanol
InChI:
InChI=1S/C10H9Cl6O2P/c11-9(12,13)7(17)19(8(18)10(14,15)16)6-4-2-1-3-5-6/h1-5,7-8,17-18H
InChI Key:
ZTCURHKSULKJMP-UHFFFAOYSA-N
SMILES:
OC(C(Cl)(Cl)Cl)P(C(C(Cl)(Cl)Cl)O)c1ccccc1
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
403.844g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
404.854g/mol
Monoisotopic Mass:
401.847g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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