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88648-59-3 | Phosphinic acid, (2-bromo-1-hydroxyethyl)-, 2-methylpropyl ester
CAS No: 88648-59-3 Catalog No: AG0049BT MDL No:
Product Description
Catalog Number:
AG0049BT
Chemical Name:
Phosphinic acid, (2-bromo-1-hydroxyethyl)-, 2-methylpropyl ester
CAS Number:
88648-59-3
Molecular Formula:
C6H14BrO3P
Molecular Weight:
245.0513
IUPAC Name:
(2-bromo-1-hydroxyethyl)-(2-methylpropoxy)-oxophosphanium
InChI:
InChI=1S/C6H13BrO3P/c1-5(2)4-10-11(9)6(8)3-7/h5-6,8H,3-4H2,1-2H3/q+1
InChI Key:
ZHBMECOJNAJCKU-UHFFFAOYSA-N
SMILES:
BrCC(P(=O)OCC(C)C)O
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.979g/mol
Formal Charge:
1
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.045g/mol
Monoisotopic Mass:
242.979g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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