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Home > Fluorides > 113548-89-3
113548-89-3 | Phosphonofluoridic acid, P-methyl-, hexyl ester
CAS No: 113548-89-3 Catalog No: AG0008Y9 MDL No:
Product Description
Catalog Number:
AG0008Y9
Chemical Name:
Phosphonofluoridic acid, P-methyl-, hexyl ester
CAS Number:
113548-89-3
Molecular Formula:
C7H16FO2P
Molecular Weight:
182.1729
IUPAC Name:
1-[fluoro(methyl)phosphoryl]oxyhexane
InChI:
InChI=1S/C7H16FO2P/c1-3-4-5-6-7-10-11(2,8)9/h3-7H2,1-2H3
InChI Key:
IPRNMZIRVLGZQD-UHFFFAOYSA-N
SMILES:
CCCCCCOP(=O)(F)C
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.087g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.175g/mol
Monoisotopic Mass:
182.087g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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