N-Benzyl-1-(4-methoxyphenyl)-2-propanamine - CAS 43229-65-8

Catalog:	BB025372
Product Name:	N-Benzyl-1-(4-methoxyphenyl)-2-propanamine
CAS:	43229-65-8
Synonyms:	1-(4-methoxyphenyl)-N-(phenylmethyl)-2-propanamine; N-benzyl-1-(4-methoxyphenyl)propan-2-amine

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Computed Properties

IUPAC Name:	N-benzyl-1-(4-methoxyphenyl)propan-2-amine
Description:	N-Benzyl-1-(4-methoxyphenyl)-2-propanamine (CAS# 43229-65-8 ) is a useful research chemical.
Molecular Weight:	255.35
Molecular Formula:	C17H21NO
Canonical SMILES:	CC(CC1=CC=C(C=C1)OC)NCC2=CC=CC=C2
InChI:	InChI=1S/C17H21NO/c1-14(18-13-16-6-4-3-5-7-16)12-15-8-10-17(19-2)11-9-15/h3-11,14,18H,12-13H2,1-2H3
InChI Key:	CVGPWMGXKOKNFD-UHFFFAOYSA-N
Boiling Point:	377.8 °C at 760 mmHg
Density:	1.024 g/cm³
Appearance:	Solid
LogP:	3.80690

Publication Number	Title	Priority Date
EP-2997009-A2	Process for the preparation of arformoterol or salt thereof	20130517
JP-2016523832-A	Process for the preparation of alformoterol or its salts	20130517
US-2016083334-A1	Process for the preparation of arformoterol or salt thereof	20130517
US-9499475-B2	Process for the preparation of arformoterol or salt thereof	20130517
WO-2014184756-A2	Process for the preparation of arformoterol or salt thereof	20130517

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Related Functional Groups

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GHS Hazard Statement:	H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P260, P264, P270, P273, P280, P301+P310, P301+P312, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P330, P363, P391, P405, and P501
Signal Word:	Danger

Complexity:	229
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	255.162314293
Formal Charge:	0
Heavy Atom Count:	19
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	255.162314293
Rotatable Bond Count:	6
Topological Polar Surface Area:	21.3 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	3.7