Dimethylphosphine Oxide - CAS 7211-39-4

Catalog:	BB034544
Product Name:	Dimethylphosphine Oxide
CAS:	7211-39-4
Synonyms:	dimethyl(oxo)phosphonium; dimethyl(oxo)phosphanium

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	dimethyl(oxo)phosphanium
Description:	Dimethylphosphine Oxide (CAS# 7211-39-4) is used in preparation of substituted piperazine derivatives as DGKα/DGKζ inhibitors for the treatment of viral infections and cancer.
Molecular Weight:	78.05
Molecular Formula:	C2H7OP
Canonical SMILES:	C[P+](=O)C
InChI:	InChI=1S/C2H6OP/c1-4(2)3/h1-2H3/q+1
InChI Key:	WQAWEUZTDVWTDB-UHFFFAOYSA-N
Boiling Point:	84.5 °C at 760 mmHg
LogP:	0.80570

Publication Number	Title	Priority Date
CN-113457746-A	Catalyst and preparation method and application thereof	20210630
CN-112661745-A	Compounds useful as CDK7 kinase inhibitors and uses thereof	20200724
WO-2021208918-A1	Tricyclic compounds as egfr inhibitors	20200414
WO-2021202874-A1	Furin inhibitors for treating coronavirus infections	20200402
WO-2021190417-A1	Novel aminopyrimidine egfr inhibitor	20200323

PMID	Publication Date	Title	Journal
28435288	20170101	The activity, safety, and evolving role of brigatinib in patients with ALK-rearranged non-small cell lung cancers	OncoTargets and therapy
19924840	20091217	Reaction pathway and free-energy barrier for reactivation of dimethylphosphoryl-inhibited human acetylcholinesterase	The journal of physical chemistry. B
19433070	20090901	Extreme variability in the formation of chlorpyrifos oxon (CPO) in patients poisoned by chlorpyrifos (CPF)	Biochemical pharmacology
17999517	20071207	Computational study of the Curtius-like rearrangements of phosphoryl, phosphinyl, and phosphinoyl azides and their corresponding nitrenes	The Journal of organic chemistry
17714697	20071101	Preparation and characterization of dialkylphosphoryl-obidoxime conjugates, potent anticholinesterase derivatives that are quickly hydrolyzed by human paraoxonase (PON1192Q)	Biochemical pharmacology

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Related Functional Groups

Phosphorus Compounds

[169689-05-8]
1S,2S-DHAC-Phenyl Trost Ligand
[65514-03-6]
1-(Methacryloyloxy)ethylphosphonic acid
[124755-24-4]
Ethyl [bis(2,2,2-trifluoroethoxy)phosphinyl]acetate
[20345-61-3]
Ethyl 2-(diethoxyphosphoryl)prop-2-enoate
[1536463-79-2]
Ethyl 2-dibutoxyphosphorylbutanoate
[23550-25-6]
Ethyl 3-(dimethoxyphosphoryl)propanoate

GHS Hazard Statement:	H226 (33.33%): Flammable liquid and vapor [Warning Flammable liquids]
Precautionary Statement:	P210, P233, P240, P241, P242, P243, P261, P264, P270, P271, P273, P280, P301+P312, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P370+P378, P403+P233, P403+P235, P405, and P501
Signal Word:	Warning

Complexity:	29
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	77.015626808
Formal Charge:	1
Heavy Atom Count:	4
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	77.015626808
Rotatable Bond Count:	0
Topological Polar Surface Area:	17.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.8