Ethyl 2,2,2-trichloroacetimidate - CAS 23213-96-9

Name: Ethyl 2,2,2-trichloroacetimidate
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB017980
Product Name:	Ethyl 2,2,2-trichloroacetimidate
CAS:	23213-96-9
Synonyms:	ethyl 2,2,2-trichloroethanimidate

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	ethyl 2,2,2-trichloroethanimidate
Description:	Ethyl 2,2,2-trichloroacetimidate (CAS# 23213-96-9 ) is a useful research chemical.
Molecular Weight:	190.46
Molecular Formula:	C4H6Cl3NO
Canonical SMILES:	CCOC(=N)C(Cl)(Cl)Cl
InChI:	InChI=1S/C4H6Cl3NO/c1-2-9-3(8)4(5,6)7/h8H,2H2,1H3
InChI Key:	JOSSZRPXOBWRQT-UHFFFAOYSA-N
Boiling Point:	74-75 °C / 39 mmHg (lit.)
Density:	1.331 g/mL at 25 °C(lit.)
Appearance:	Liquid
LogP:	2.47010

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Related Functional Groups

Nitrogen Compounds

[89908-23-6]C23H22N2O5
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[32894-07-8]C9H11NS · HCl
Benzyl thioacetimidate hydrochloride
[618-40-6]C7H10N2
1-Methyl-1-phenylhydrazine
[2006278-12-0]C13H9BrN2O
2-[(5-Bromo-3-pyridyl)oxy]-2-phenylacetonitrile
[1170836-29-9]C12H12F3N5
3-(1',3'-Dimethyl-5-(trifluoromethyl)-1'H,2H-[3,4'-bipyrazol]-2-yl)propanenitrile
[5724-76-5]C7H9NO4
3-(2,5-Dioxopyrrolidin-1-yl)propionic acid

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
CN-110105245-A	A kind of preparation method of Vernakalant intermediate 3,4- Dimethoxyphenethyl 2,2,2- tribromo-acetyl imines	20180201
US-10695319-B2	Glucose conjugates of triptolide, analogs and uses thereof	20160204
WO-2017093409-A1	Pesticidal compounds and their uses	20151203
AU-2012285931-B2	Novel substituted indole derivatives as gamma secretase modulators	20110715
CA-2841102-A1	Novel substituted indole derivatives as gamma secretase modulators	20110715

Complexity:	109
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	188.951497
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	188.951497
Rotatable Bond Count:	2
Topological Polar Surface Area:	33.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.4