6-Bromo-4-chloro-2-methylquinoline - CAS 53364-85-5

Catalog:	BB028174
Product Name:	6-Bromo-4-chloro-2-methylquinoline
CAS:	53364-85-5
Synonyms:	6-bromo-4-chloro-2-methylquinoline

Technical Data

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Computed Properties

IUPAC Name:	6-bromo-4-chloro-2-methylquinoline
Description:	6-Bromo-4-chloro-2-methylquinoline (CAS# 53364-85-5) is a useful research chemical.
Molecular Weight:	256.53
Molecular Formula:	C10H7BrClN
Canonical SMILES:	CC1=NC2=C(C=C(C=C2)Br)C(=C1)Cl
InChI:	InChI=1S/C10H7BrClN/c1-6-4-9(12)8-5-7(11)2-3-10(8)13-6/h2-5H,1H3
InChI Key:	OCNREXWJWVKEEB-UHFFFAOYSA-N
Boiling Point:	321.9 °C at 760 mmHg
Purity:	97 %
Density:	1.591 g/cm³
MDL:	MFCD00272373
LogP:	3.95910

Publication Number	Title	Priority Date
TW-202100512-A	A fused aromatic ring derivative, a preparation method thereof, and medical use thereof	20190306
WO-2020177729-A1	Fused aromatic ring derivative, preparation method therefor, and pharmaceutical application thereof	20190306
CN-112955432-A	Fused aromatic ring derivative, preparation method and medical application thereof	20190306
WO-2020096916-A2	Inhibitors of histone deacetylase useful for the treatment or prevention of hiv infection	20181108
EP-3876928-A2	Inhibitors of histone deacetylase useful for the treatment or prevention of hiv infection	20181108

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Related Functional Groups

Quinoline/Isoquinoline

[203506-30-3]
2-Amino-6-methoxy-3-methylquinoline
[30740-95-5]
6,7-Dimethoxy-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid hydrochloride
[938001-63-9]
9-Chloro-1-methyl-5,6,7,8-tetrahydro-1H-pyrazolo[4,3-b]quinoline
[77156-78-6]
4-Hydroxy-6-methoxyquinoline-3-carboxylic acid ethyl ester
[312713-96-5]
7-Chloro-6-methyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-4-carboxylic acid
[19490-87-0]
7-Methoxy-2-methylquinoline

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GHS Hazard Statement:	H301 (97.44%): Toxic if swallowed [Danger Acute toxicity, oral]; H318 (97.44%): Causes serious eye damage [Danger Serious eye damage/eye irritation]; H413 (97.44%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
Precautionary Statement:	P264, P264+P265, P270, P273, P280, P301+P316, P305+P354+P338, P317, P321, P330, P405, and P501
Signal Word:	Danger

Complexity:	188
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	254.94504
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	254.94504
Rotatable Bond Count:	0
Topological Polar Surface Area:	12.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.9