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16498-01-4 | Phosphoric acid, 4-bromophenyl diethyl ester
CAS No: 16498-01-4 Catalog No: AG001V7H MDL No:
Product Description
Catalog Number:
AG001V7H
Chemical Name:
Phosphoric acid, 4-bromophenyl diethyl ester
CAS Number:
16498-01-4
Molecular Formula:
C10H14BrO4P
Molecular Weight:
309.0935
IUPAC Name:
(4-bromophenyl) diethyl phosphate
InChI:
InChI=1S/C10H14BrO4P/c1-3-13-16(12,14-4-2)15-10-7-5-9(11)6-8-10/h5-8H,3-4H2,1-2H3
InChI Key:
VFNLVHJJCJDLRL-UHFFFAOYSA-N
SMILES:
CCOP(=O)(Oc1ccc(cc1)Br)OCC
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.981g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
309.096g/mol
Monoisotopic Mass:
307.981g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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