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2404-73-1 | Dibutyl methylphosphonate
CAS No: 2404-73-1 Catalog No: AG003PNR MDL No:MFCD00015242
Product Description
Catalog Number:
AG003PNR
Chemical Name:
Dibutyl methylphosphonate
CAS Number:
2404-73-1
Molecular Formula:
C9H21O3P
Molecular Weight:
208.2350
MDL Number:
MFCD00015242
IUPAC Name:
1-[butoxy(methyl)phosphoryl]oxybutane
InChI:
InChI=1S/C9H21O3P/c1-4-6-8-11-13(3,10)12-9-7-5-2/h4-9H2,1-3H3
InChI Key:
NPNBLTJGRBYCJB-UHFFFAOYSA-N
SMILES:
CCCCOP(=O)(OCCCC)C
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.123g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.238g/mol
Monoisotopic Mass:
208.123g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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