N-(2-Chlorobenzylidene)-4-methoxyaniline - CAS 17099-11-5

Name: N-(2-Chlorobenzylidene)-4-methoxyaniline
Brand: BOC Sciences
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Catalog:	BB012694
Product Name:	N-(2-Chlorobenzylidene)-4-methoxyaniline
CAS:	17099-11-5
Synonyms:	1-(2-chlorophenyl)-N-(4-methoxyphenyl)methanimine

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	1-(2-chlorophenyl)-N-(4-methoxyphenyl)methanimine
Description:	N-(2-Chlorobenzylidene)-4-methoxyaniline (CAS# 17099-11-5 ) is a useful research chemical.
Molecular Weight:	245.70
Molecular Formula:	C14H12ClNO
Canonical SMILES:	COC1=CC=C(C=C1)N=CC2=CC=CC=C2Cl
InChI:	InChI=1S/C14H12ClNO/c1-17-13-8-6-12(7-9-13)16-10-11-4-2-3-5-14(11)15/h2-10H,1H3
InChI Key:	LSBFMYAAXUQSLF-UHFFFAOYSA-N
Boiling Point:	385.8 °C at 760 mmHg
Density:	1.11 g/cm³
MDL:	MFCD00018306
LogP:	4.09920

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Related Functional Groups

Nitrogen Compounds

[89908-23-6]C23H22N2O5
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[333311-69-6]C12H12BrN3O2
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[1281984-38-0]C8H10N4O4
1-Cyclopentyl-3,5-dinitro-1H-pyrazole
[1170836-25-5]C8H11N3O2
1-Cyclopentyl-5-nitro-1H-pyrazole
[78056-67-4]C14H18N2
2-(1-Benzyl-4-piperidyl)acetonitrile

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Publication Number	Title	Priority Date
JP-2014084286-A	Amine compound, production method and use thereof, production intermediate and production intermediate production method	20121022
JP-5998841-B2	Amine compound, production method and use thereof, production intermediate and production intermediate production method	20121022
US-2008214547-A1	Methods and compositions of trail-death receptor agonists/activators	20070201
US-2011172234-A1	Methods and compositions of trail-death receptor agonists/activators	20070201
US-7915245-B2	Methods and compositions of trail-death receptor agonists/activators	20070201

Complexity:	249
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	245.0607417
Formal Charge:	0
Heavy Atom Count:	17
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	245.0607417
Rotatable Bond Count:	3
Topological Polar Surface Area:	21.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.8