Ethyl Allyl(2,2-dimethoxyethyl)carbamate - CAS 128740-02-3

Catalog:	BB006927
Product Name:	Ethyl Allyl(2,2-dimethoxyethyl)carbamate
CAS:	128740-02-3
Synonyms:	N-(2,2-dimethoxyethyl)-N-prop-2-enylcarbamic acid ethyl ester; ethyl N-(2,2-dimethoxyethyl)-N-prop-2-enylcarbamate

Technical Data

Patents

Computed Properties

IUPAC Name:	ethyl N-(2,2-dimethoxyethyl)-N-prop-2-enylcarbamate
Description:	Ethyl Allyl(2,2-dimethoxyethyl)carbamate (CAS# 128740-02-3 ) is a useful research chemical.
Molecular Weight:	217.26
Molecular Formula:	C10H19NO4
Canonical SMILES:	CCOC(=O)N(CC=C)CC(OC)OC
InChI:	InChI=1S/C10H19NO4/c1-5-7-11(10(12)15-6-2)8-9(13-3)14-4/h5,9H,1,6-8H2,2-4H3
InChI Key:	SXIOXBYMPVICFV-UHFFFAOYSA-N
Boiling Point:	270.101 °C at 760 mmHg
Density:	1.022 g/cm³
LogP:	1.24980

Publication Number	Title	Priority Date
AU-2016303558-A1	Dopamine D3 receptor antagonists having a bicyclo moiety	20150805
CA-2992820-A1	Dopamine d3 receptor antagonists having a bicyclo moiety	20150805
EP-3331886-A1	Dopamine d3 receptor antagonists having a bicyclo moiety	20150805
US-10273244-B2	Substituted hexahydropyrrolo[3,4-b]pyrroles and hexahydrocyclopenta[c]pyrroles as dopamine receptor modulators	20150805
US-10584135-B2	Substituted 3,6-diazabicyclo[3.2.0]heptanes	20150805

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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:	217.13140809
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	217.13140809
Rotatable Bond Count:	8
Topological Polar Surface Area:	48
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1