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101834-90-6 | Acetic acid, 2-bromo-2-chloro-2-(diethoxyphosphinyl)-, ethyl ester
CAS No: 101834-90-6 Catalog No: AG0005OZ MDL No:
Product Description
Catalog Number:
AG0005OZ
Chemical Name:
Acetic acid, 2-bromo-2-chloro-2-(diethoxyphosphinyl)-, ethyl ester
CAS Number:
101834-90-6
Molecular Formula:
C8H15BrClO5P
Molecular Weight:
337.5325
IUPAC Name:
ethyl 2-bromo-2-chloro-2-diethoxyphosphorylacetate
InChI:
InChI=1S/C8H15BrClO5P/c1-4-13-7(11)8(9,10)16(12,14-5-2)15-6-3/h4-6H2,1-3H3
InChI Key:
IMPABOMWLNEFPV-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(P(=O)(OCC)OCC)(Br)Cl
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.953g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
337.531g/mol
Monoisotopic Mass:
335.953g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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