2-(2-Chloroethoxy)acetamide - CAS 36961-64-5

Catalog:	BB023155
Product Name:	2-(2-Chloroethoxy)acetamide
CAS:	36961-64-5
Synonyms:	2-(2-chloroethoxy)acetamide; 2-(2-chloroethoxy)acetamide

Technical Data

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Computed Properties

IUPAC Name:	2-(2-chloroethoxy)acetamide
Description:	2-(2-Chloroethoxy)acetamide (CAS# 36961-64-5) is a useful research chemical.
Molecular Weight:	137.56
Molecular Formula:	C4H8ClNO2
Canonical SMILES:	C(CCl)OCC(=O)N
InChI:	InChI=1S/C4H8ClNO2/c5-1-2-8-3-4(6)7/h1-3H2,(H2,6,7)
InChI Key:	KQHRCXCLILUNBX-UHFFFAOYSA-N
Boiling Point:	289.3 °C at 760 mmHg
Density:	1.216 g/cm³
LogP:	0.42740

Publication Number	Title	Priority Date
JP-6938628-B2	1,3-disubstituted cyclobutane or azetidine derivative as hematopoietic prostaglandin D synthase inhibitor	20161013
CN-105085515-B	Hydrazide kind compound as coagulation factor xa inhibitors	20140522
JP-2017516845-A	Hydrazide compounds as blood coagulation factor Xa inhibitors	20140522
TW-201524960-A	Substituted 6,7-dialkoxy-3-isoquinoline derivatives as inhibitors of phosphodiesterase 10 (PDE10A)	20131219
JP-2012512886-A	Carbazole and carboline kinase inhibitors	20081219

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P201, P202, P264, P270, P280, P281, P301+P312, P305+P351+P338, P308+P313, P330, P337+P313, P405, and P501
Signal Word:	Warning

Complexity:	76.4
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	137.0243562
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	137.0243562
Rotatable Bond Count:	4
Topological Polar Surface Area:	52.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.4