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114176-70-4 | Phosphonic acid, methyl-, mono(2,3-dibromopropyl) ester (9CI)
CAS No: 114176-70-4 Catalog No: AG000AQK MDL No:
Product Description
Catalog Number:
AG000AQK
Chemical Name:
Phosphonic acid, methyl-, mono(2,3-dibromopropyl) ester (9CI)
CAS Number:
114176-70-4
Molecular Formula:
C4H8Br2O3P-
Molecular Weight:
294.8863
IUPAC Name:
2,3-dibromopropoxy(methyl)phosphinate
InChI:
InChI=1S/C4H9Br2O3P/c1-10(7,8)9-3-4(6)2-5/h4H,2-3H2,1H3,(H,7,8)/p-1
InChI Key:
JMHFFXFNGJDCEN-UHFFFAOYSA-M
SMILES:
[O-]P(=O)(OCC(CBr)Br)C
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.856g/mol
Formal Charge:
-1
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
294.887g/mol
Monoisotopic Mass:
292.858g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
49.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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