3-Amino-2'-methylbiphenyl - CAS 400745-54-2

Catalog:	BB024284
Product Name:	3-Amino-2'-methylbiphenyl
CAS:	400745-54-2
Synonyms:	3-(2-methylphenyl)aniline; 3-(2-methylphenyl)aniline

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	3-(2-methylphenyl)aniline
Description:	3-Amino-2'-methylbiphenyl (CAS# 400745-54-2) is a useful research chemical.
Molecular Weight:	183.25
Molecular Formula:	C13H13N
Canonical SMILES:	CC1=CC=CC=C1C2=CC(=CC=C2)N
InChI:	InChI=1S/C13H13N/c1-10-5-2-3-8-13(10)11-6-4-7-12(14)9-11/h2-9H,14H2,1H3
InChI Key:	VSKSSQACZWHPED-UHFFFAOYSA-N
Boiling Point:	334.1 °C at 760 mmHg
Density:	1.057 g/cm³
LogP:	3.82540

Publication Number	Title	Priority Date
EP-3842444-A1	Organometallic compound, organic light-emitting device including the same and electronic apparatus including the organic light-emitting device	20191224
EP-3828951-A1	Organic electronic device and display device comprising the organic electronic device as well as organic compounds for use in organic electronic devices	20191127
EP-3825320-A1	Organometallic compound, organic light-emitting device including organometallic compound, and diagnostic composition including organometallic compound	20191125
EP-3798225-A1	Organometallic compound, organic light-emitting device including the same and electronic apparatus including the organic light-emitting device	20190926
WO-2021014001-A1	Organic molecules for optoelectronic devices	20190725

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Related Functional Groups

Amines and Anilines

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[3-(Difluoromethoxy)phenyl]methanamine hydrochloride
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1-(4-Bromo-2-ethylpyrazol-3-yl)-N-methylmethanamine hydrochloride
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2-(1-Benzyl-3-pyrazolyl)ethylamine

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	178
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	183.104799419
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	183.104799419
Rotatable Bond Count:	1
Topological Polar Surface Area:	26
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3