4-(1-Naphthalenyloxy)-benzenemethanamine - CAS 1803561-55-8

Catalog:	BB058820
Product Name:	4-(1-Naphthalenyloxy)-benzenemethanamine
CAS:	1803561-55-8
Synonyms:	[4-(naphthalen-1-yloxy)phenyl]methanamine hydrochloride; (4-naphthalen-1-yloxyphenyl)methanamine; hydrochloride; (4-(Naphthalen-1-yloxy)phenyl)methanamine hydrochloride

Technical Data

Safety and Hazards

Computed Properties

IUPAC Name:	(4-naphthalen-1-yloxyphenyl)methanaminehydrochloride
Description:	4-(1-Naphthalenyloxy)-benzenemethanamine is a useful research chemical.
Molecular Weight:	249.31 + 36.46
Molecular Formula:	C17H15NO·HCl
Canonical SMILES:	C1=CC=C2C(=C1)C=CC=C2OC3=CC=C(C=C3)CN.Cl
InChI:	InChI=1S/C17H15NO.ClH/c18-12-13-8-10-15(11-9-13)19-17-7-3-5-14-4-1-2-6-16(14)17/h1-11H,12,18H21H
InChI Key:	HGSRHKYTTJOVJJ-UHFFFAOYSA-N

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	272
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	285.0920418
Formal Charge:	0
Heavy Atom Count:	20
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	285.0920418
Rotatable Bond Count:	3
Topological Polar Surface Area:	35.2Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0