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115792-08-0 | Phosphonofluoridic acid, methyl-, 2-hydroxy-1,1,2-trimethylpropyl ester (9CI)
CAS No: 115792-08-0 Catalog No: AG000GVE MDL No:
Product Description
Catalog Number:
AG000GVE
Chemical Name:
Phosphonofluoridic acid, methyl-, 2-hydroxy-1,1,2-trimethylpropyl ester (9CI)
CAS Number:
115792-08-0
Molecular Formula:
C7H16FO3P
Molecular Weight:
198.1723
IUPAC Name:
3-[fluoro(methyl)phosphoryl]oxy-2,3-dimethylbutan-2-ol
InChI:
InChI=1S/C7H16FO3P/c1-6(2,9)7(3,4)11-12(5,8)10/h9H,1-5H3
InChI Key:
QRTSTIDULHNWGI-UHFFFAOYSA-N
SMILES:
CP(=O)(OC(C(O)(C)C)(C)C)F
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.082g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.174g/mol
Monoisotopic Mass:
198.082g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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