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2053-81-8 | Phosphonofluoridic acid, P-methyl-, 2-methylpropyl ester
CAS No: 2053-81-8 Catalog No: AG002A01 MDL No:
Product Description
Catalog Number:
AG002A01
Chemical Name:
Phosphonofluoridic acid, P-methyl-, 2-methylpropyl ester
CAS Number:
2053-81-8
Molecular Formula:
C5H12FO2P
Molecular Weight:
154.1197
IUPAC Name:
1-[fluoro(methyl)phosphoryl]oxy-2-methylpropane
InChI:
InChI=1S/C5H12FO2P/c1-5(2)4-8-9(3,6)7/h5H,4H2,1-3H3
InChI Key:
UNEQLTBUKVDOIT-UHFFFAOYSA-N
SMILES:
CC(COP(=O)(F)C)C
Properties
Complexity:
124
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.056g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.121g/mol
Monoisotopic Mass:
154.056g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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