3-(Aminomethyl)-N-methylaniline - CAS 768343-60-8

Catalog:	BB035713
Product Name:	3-(Aminomethyl)-N-methylaniline
CAS:	768343-60-8
Synonyms:	3-(aminomethyl)-N-methylaniline; 3-(aminomethyl)-N-methylaniline

Technical Data

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Computed Properties

IUPAC Name:	3-(aminomethyl)-N-methylaniline
Description:	3-(Aminomethyl)-N-methylaniline (CAS# 768343-60-8) is a useful research chemical.
Molecular Weight:	136.19
Molecular Formula:	C8H12N2
Canonical SMILES:	CNC1=CC=CC(=C1)CN
InChI:	InChI=1S/C8H12N2/c1-10-8-4-2-3-7(5-8)6-9/h2-5,10H,6,9H2,1H3
InChI Key:	XDEDGESLTYFNGL-UHFFFAOYSA-N
Boiling Point:	148-152 °C
Density:	1.056 g/cm³
MDL:	MFCD04037894
LogP:	1.96030

Publication Number	Title	Priority Date
WO-2020145175-A1	Liquid crystal alignment agent, liquid crystal alignment film, and liquid crystal display element	20190108
WO-2020138259-A1	Liquid crystal aligning agent, liquid crystal alignment film, liquid crystal display element, and novel monomer	20181227
WO-2020045548-A1	Method for producing liquid crystal alignment film, liquid crystal alignment film, and liquid crystal display element	20180831
WO-2020045549-A1	Liquid crystal aligning agent, liquid crystal alignment film and liquid crystal display element	20180830
US-2018077899-A1	Methods and Compositions for Dag Mitigation	20160922

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GHS Hazard Statement:	H302 (50%): 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:	93.3
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	136.100048391
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	136.100048391
Rotatable Bond Count:	2
Topological Polar Surface Area:	38 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.8