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Home > Fluorides > 137073-22-4
137073-22-4 | 4H-1,3,2-Benzodioxaphosphorin-4-one, 2-(2,2,2-trifluoroethoxy)-
CAS No: 137073-22-4 Catalog No: AG0012SR MDL No:
Product Description
Catalog Number:
AG0012SR
Chemical Name:
4H-1,3,2-Benzodioxaphosphorin-4-one, 2-(2,2,2-trifluoroethoxy)-
CAS Number:
137073-22-4
Molecular Formula:
C9H6F3O4P
Molecular Weight:
266.1105
IUPAC Name:
2-(2,2,2-trifluoroethoxy)-1,3,2-benzodioxaphosphinin-4-one
InChI:
InChI=1S/C9H6F3O4P/c10-9(11,12)5-14-17-15-7-4-2-1-3-6(7)8(13)16-17/h1-4H,5H2
InChI Key:
ZPYLEVVMOLGMQK-UHFFFAOYSA-N
SMILES:
O=C1OP(OCC(F)(F)F)Oc2c1cccc2
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.996g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.112g/mol
Monoisotopic Mass:
265.996g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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