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206754-21-4 | Phosphonic acid, P-(bromofluoromethyl)-, diethyl ester
CAS No: 206754-21-4 Catalog No: AG002INO MDL No:
Product Description
Catalog Number:
AG002INO
Chemical Name:
Phosphonic acid, P-(bromofluoromethyl)-, diethyl ester
CAS Number:
206754-21-4
Molecular Formula:
C5H11BrFO3P
Molecular Weight:
249.0152
IUPAC Name:
1-[[bromo(fluoro)methyl]-ethoxyphosphoryl]oxyethane
InChI:
InChI=1S/C5H11BrFO3P/c1-3-9-11(8,5(6)7)10-4-2/h5H,3-4H2,1-2H3
InChI Key:
GCJZFEOFDUEOKD-UHFFFAOYSA-N
SMILES:
CCOP(=O)(C(Br)F)OCC
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.961g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.016g/mol
Monoisotopic Mass:
247.961g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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