1-(3-Chlorophenyl)ethylamine - CAS 24358-43-8

Catalog:	BB018431
Product Name:	1-(3-Chlorophenyl)ethylamine
CAS:	24358-43-8
Synonyms:	1-(3-chlorophenyl)ethanamine; 1-(3-chlorophenyl)ethanamine

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Computed Properties

IUPAC Name:	1-(3-chlorophenyl)ethanamine
Description:	1-(3-Chlorophenyl)ethylamine (CAS# 24358-43-8) is a chlorinated arylamine used in the preparation of anticonvulsants.
Molecular Weight:	155.62
Molecular Formula:	C8H10ClN
Canonical SMILES:	CC(C1=CC(=CC=C1)Cl)N
InChI:	InChI=1S/C8H10ClN/c1-6(10)7-3-2-4-8(9)5-7/h2-6H,10H2,1H3
InChI Key:	DQEYVZASLGNODG-UHFFFAOYSA-N
Boiling Point:	215.8 °C at 760 mmHg
Density:	1.122 g/cm³
MDL:	MFCD05215231
LogP:	3.06000

Publication Number	Title	Priority Date
US-2021078999-A1	Plasma kallikrein inhibitors and uses thereof	20190918
WO-2021055621-A1	Plasma kallikrein inhibitors and uses thereof	20190918
US-10568874-B2	Indane-amines as PD-L1 antagonists	20180222
US-2019282555-A1	Indane-amines as pd-l1 antagonists	20180222
EP-3483149-A1	Benzo[d]thiazole derivative or salt thereof, and pharmaceutical composition including same	20160708

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GHS Hazard Statement:	H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement:	P264, P280, P305+P351+P338, and P337+P313
Signal Word:	Warning

Complexity:	105
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	155.0501770
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	155.0501770
Rotatable Bond Count:	1
Topological Polar Surface Area:	26 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	2.2