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N-(3-Methoxybenzyl)cyclopropanamine

N-(3-Methoxybenzyl)cyclopropanamine - CAS 625437-31-2

Catalog:	BB050090
Product Name:	N-(3-Methoxybenzyl)cyclopropanamine
CAS:	625437-31-2
Synonyms:	Benzenemethanamine, N-cyclopropyl-3-methoxy- (9CI); cyclopropyl[(3-methoxyphenyl)methyl]amine

Technical Data

Safety and Hazards

Computed Properties

IUPAC Name:	N-[(3-methoxyphenyl)methyl]cyclopropanamine
Description:	N-(3-Methoxybenzyl)cyclopropanamine (CAS# 625437-31-2 ) is a useful research chemical.
Molecular Weight:	177.24
Molecular Formula:	C11H15NO
Canonical SMILES:	COC1=CC=CC(=C1)CNC2CC2
InChI:	InChI=1S/C11H15NO/c1-13-11-4-2-3-9(7-11)8-12-10-5-6-10/h2-4,7,10,12H,5-6,8H2,1H3
InChI Key:	NUPAMNLYORQZRV-UHFFFAOYSA-N
Boiling Point:	277.2±15.0 °C at 760 mmHg
Purity:	95 %
Density:	1.1±0.1 g/cm³

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Related Functional Groups

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Nitrogen Compounds

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2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
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1-(Chloromethyl)-3-nitro-1H-pyrazole
[618-40-6]
1-Methyl-1-phenylhydrazine

Oxygen Compounds

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Z-Glycinol
[202288-73-1]
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GHS Hazard Statement:	H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]; H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Precautionary Statement:	P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501
Signal Word:	Danger

Complexity:	156
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	177.115364102
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	177.115364102
Rotatable Bond Count:	4
Topological Polar Surface Area:	21.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2