2-Phenoxyacetamidine Hydrochloride - CAS 67386-38-3

Catalog:	BB033267
Product Name:	2-Phenoxyacetamidine Hydrochloride
CAS:	67386-38-3
Synonyms:	2-phenoxyethanimidamide;hydrochloride; 2-phenoxyethanimidamide;hydrochloride

Technical Data

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Computed Properties

IUPAC Name:	2-phenoxyethanimidamide;hydrochloride
Description:	2-Phenoxyacetamidine Hydrochloride (CAS# 67386-38-3) is a useful research chemical.
Molecular Weight:	186.64
Molecular Formula:	C8H11ClN2O
Canonical SMILES:	C1=CC=C(C=C1)OCC(=N)N.Cl
InChI:	InChI=1S/C8H10N2O.ClH/c9-8(10)6-11-7-4-2-1-3-5-7;/h1-5H,6H2,(H3,9,10);1H
InChI Key:	ZLZLLGGMCNVVAS-UHFFFAOYSA-N
Boiling Point:	269.3 °C at 760 mmHg
MDL:	MFCD00173806
LogP:	2.60340

Publication Number	Title	Priority Date
AU-2014274644-B2	New thienopyrimidine derivatives, a process for their preparation and pharmaceutical compositions containing them	20131223
CA-2875226-A1	Thienopyrimidine derivatives, process for their preparation, pharmaceutical compositions containing them and their use in the treatment of conditions involving a defect in apoptosis	20131223
CA-2875226-C	Thienopyrimidine derivatives, process for their preparation, pharmaceutical compositions containing them and their use in the treatment of conditions involving a defect in apoptosis	20131223
DK-2886545-T3	Thienopyrimidinderivater new, a process for their preparation and pharmaceutical compositions containing them	20131223
EP-2886545-A1	New thienopyrimidine derivatives, a process for their preparation and pharmaceutical compositions containing them	20131223

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	130
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	186.0559907
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	186.0559907
Rotatable Bond Count:	3
Topological Polar Surface Area:	59.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0