2-(4-Isopropoxyphenyl)ethylamine - CAS 88655-02-1

Catalog:	BB039131
Product Name:	2-(4-Isopropoxyphenyl)ethylamine
CAS:	88655-02-1
Synonyms:	2-(4-propan-2-yloxyphenyl)ethanamine; 2-(4-propan-2-yloxyphenyl)ethanamine

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	2-(4-propan-2-yloxyphenyl)ethanamine
Description:	2-(4-Isopropoxyphenyl)ethylamine (CAS# 88655-02-1 ) is a useful research chemical.
Molecular Weight:	179.26
Molecular Formula:	C11H17NO
Canonical SMILES:	CC(C)OC1=CC=C(C=C1)CCN
InChI:	InChI=1S/C11H17NO/c1-9(2)13-11-5-3-10(4-6-11)7-8-12/h3-6,9H,7-8,12H2,1-2H3
InChI Key:	PNHKLHKLRYLHAQ-UHFFFAOYSA-N
MDL:	MFCD03444569
LogP:	2.67530

Publication Number	Title	Priority Date
US-2021171554-A1	Benzothiophene estrogen receptor modulators to treat medical disorders	20180816
EP-3483149-A1	Benzo[d]thiazole derivative or salt thereof, and pharmaceutical composition including same	20160708
JP-2019520403-A	Benzo [D] thiazole derivative or salt thereof, and pharmaceutical composition containing the same	20160708
KR-20180006167-A	Benzo[d]thiazole derivative or its salt and pharmaceutical composition comprising the same	20160708
US-10383859-B2	Benzo[d]thiazole derivative or salt thereof, and pharmaceutical composition including same	20160708

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Related Functional Groups

Amines and Anilines

[556-90-1]
Pseudothiohydantoin
[1232060-85-3]
(3R,4R)-4-Amino-3-methoxytetrahydropyran
[1158353-54-8]
(4-Pyrazol-1-ylphenyl)methanamine sulfuric acid
[1006473-17-1]
[(2,3-Difluorophenyl)methyl][(1,3-dimethylpyrazol-4-yl)methyl]amine
[1431965-90-0]
1-Cyclopentyl-5-methylpyrazol-3-amine hydrochloride
[1082066-00-9]
1-Cyclopropyl-1H-pyrazole-4-carbaldehyde

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P330, P363, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	128
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	179.131014166
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	179.131014166
Rotatable Bond Count:	4
Topological Polar Surface Area:	35.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2