Diethyl (2-Oxobutyl)phosphonate - CAS 1067-73-8

Catalog:	BB001917
Product Name:	Diethyl (2-Oxobutyl)phosphonate
CAS:	1067-73-8
Synonyms:	1-diethoxyphosphoryl-2-butanone; 1-diethoxyphosphorylbutan-2-one

Technical Data

Patents

Computed Properties

IUPAC Name:	1-diethoxyphosphorylbutan-2-one
Description:	Diethyl (2-Oxobutyl)phosphonate (CAS# 1067-73-8) is a useful research chemical compound.
Molecular Weight:	208.19
Molecular Formula:	C8H17O4P
Canonical SMILES:	CCC(=O)CP(=O)(OCC)OCC
InChI:	InChI=1S/C8H17O4P/c1-4-8(9)7-13(10,11-5-2)12-6-3/h4-7H2,1-3H3
InChI Key:	GQBVFZDYDHGZPY-UHFFFAOYSA-N
Boiling Point:	280.5 °C at 760 mmHg
Density:	1.072 g/mL at 25°C(lit.)
Appearance:	Colorless liquid
Storage:	Sealed in dry, 2-8 °C
MDL:	MFCD03427248
LogP:	2.23160

Publication Number	Title	Priority Date
PL-236888-B1	Dialkyl Î²-ketophosphonate thiosemicarbazones and the method of their preparation	20170725
US-2015111372-A1	Phosphorus and arsenic doping of semiconductor materials	20131021
EP-2545583-A1	Methods and compositions for doping silicon substrates with molecular monolayers	20100308
EP-2545583-B1	Methods and compositions for doping silicon substrates with molecular monolayers	20100308
JP-2013522878-A	Method and composition for doping a silicon substrate with a monolayer	20100308

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Complexity:	192
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	208.08644602
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	208.08644602
Rotatable Bond Count:	7
Topological Polar Surface Area:	52.6
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.4