5-Chloro-1,2,3,4-tetrahydroisoquinoline - CAS 73075-43-1

Catalog:	BB034756
Product Name:	5-Chloro-1,2,3,4-tetrahydroisoquinoline
CAS:	73075-43-1
Synonyms:	5-chloro-1,2,3,4-tetrahydroisoquinoline; 5-chloro-1,2,3,4-tetrahydroisoquinoline

Technical Data

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Computed Properties

IUPAC Name:	5-chloro-1,2,3,4-tetrahydroisoquinoline
Description:	5-Chloro-1,2,3,4-tetrahydroisoquinoline (CAS# 73075-43-1) is a useful research chemical.
Molecular Weight:	167.64
Molecular Formula:	C9H10ClN
Canonical SMILES:	C1CNCC2=C1C(=CC=C2)Cl
InChI:	InChI=1S/C9H10ClN/c10-9-3-1-2-7-6-11-5-4-8(7)9/h1-3,11H,4-6H2
InChI Key:	OHOZWCJUZQXMAW-UHFFFAOYSA-N
Boiling Point:	276 °C
Density:	1.162 g/cm³
MDL:	MFCD08544277
LogP:	3.11650

Publication Number	Title	Priority Date
CN-110483511-A	A kind of synthetic method of quinazolinone polycyclic compounds	20190909
CN-110483511-B	Synthetic method of quinazolinone polycyclic compound	20190909
EP-3617186-A1	Fluoroallylamine derivative and use thereof	20170428
US-2020087248-A1	Fluoroallylamine Derivative And Use Thereof	20170428
WO-2018196677-A1	Fluoroallylamine derivative and use thereof	20170428

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Related Functional Groups

Quinoline/Isoquinoline

[203506-30-3]
2-Amino-6-methoxy-3-methylquinoline
[938459-19-9]
2-Chloro-4-methyl-7-(methylthio)quinoline
[361982-79-8]
2-Chloro-4-methyl-7,8-dihydro-6H-cyclopenta[g]quinoline
[91092-92-1]
3-Carbomethoxy-1,2,3,4-tetrahydroisoquinoline-1,4-dione
[892874-65-6]
2,7-Dimethylquinoline-3-carboxylic acid ethyl ester
[1245816-24-3]
8-(Tributylstannyl)isoquinoline

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GHS Hazard Statement:	H302 (100%): 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, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	138
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	167.0501770
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	167.0501770
Rotatable Bond Count:	0
Topological Polar Surface Area:	12 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2