6-Bromo-4-Methylquinoline-3-carboxylic acid - CAS 1095010-36-8

Name: 6-Bromo-4-Methylquinoline-3-carboxylic acid
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB002498
Product Name:	6-Bromo-4-Methylquinoline-3-carboxylic acid
CAS:	1095010-36-8
Synonyms:	6-bromo-4-methylquinoline-3-carboxylic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	6-bromo-4-methylquinoline-3-carboxylic acid
Description:	6-Bromo-4-Methylquinoline-3-carboxylic acid (CAS# 1095010-36-8) is a useful research chemical.
Molecular Weight:	266.09
Molecular Formula:	C11H8BrNO2
Canonical SMILES:	CC1=C2C=C(C=CC2=NC=C1C(=O)O)Br
InChI:	InChI=1S/C11H8BrNO2/c1-6-8-4-7(12)2-3-10(8)13-5-9(6)11(14)15/h2-5H,1H3,(H,14,15)
InChI Key:	JWZOKLNGXQIFLK-UHFFFAOYSA-N
Purity:	95 %
LogP:	3.00390

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Related Functional Groups

Quinoline/Isoquinoline

[871507-15-2]C23H18N2O2
2-(Pyridin-4-yl)-1-(4-(quinolin-2-ylmethoxy)phenyl)ethan-1-one
[1936054-65-7]C11H9Cl2N
2,4-Dichloro-3,6-dimethylquinoline
[91092-92-1]C11H9NO4
3-Carbomethoxy-1,2,3,4-tetrahydroisoquinoline-1,4-dione
[30740-95-5]C12H16ClNO4
6,7-Dimethoxy-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid hydrochloride
[892874-65-6]C14H15NO2
2,7-Dimethylquinoline-3-carboxylic acid ethyl ester
[77156-78-6]C13H13NO4
4-Hydroxy-6-methoxyquinoline-3-carboxylic acid ethyl ester

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement:	P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
EP-3592731-A1	Inhibitors of malt1 and uses thereof	20170308
JP-2020511454-A	Inhibitors of MALT1 and their use	20170308
WO-2018165385-A1	Inhibitors of malt1 and uses thereof	20170308
US-2020385405-A1	Inhibitors of malt1 and uses thereof	20170308
US-10689366-B2	Compounds for MALT1 degredation	20161101

Complexity:	259
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	264.97384
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	264.97384
Rotatable Bond Count:	1
Topological Polar Surface Area:	50.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.8