7-Bromo-2-chloroquinoline-3-carboxaldehyde - CAS 136812-31-2

Name: 7-Bromo-2-chloroquinoline-3-carboxaldehyde
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB008424
Product Name:	7-Bromo-2-chloroquinoline-3-carboxaldehyde
CAS:	136812-31-2
Synonyms:	7-bromo-2-chloroquinoline-3-carbaldehyde

Technical Data

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Patents

Computed Properties

IUPAC Name:	7-bromo-2-chloroquinoline-3-carbaldehyde
Description:	7-Bromo-2-chloroquinoline-3-carboxaldehyde (CAS# 136812-31-2) is a useful research chemical.
Molecular Weight:	270.51
Molecular Formula:	C10H5BrClNO
Canonical SMILES:	C1=CC(=CC2=NC(=C(C=C21)C=O)Cl)Br
InChI:	InChI=1S/C10H5BrClNO/c11-8-2-1-6-3-7(5-14)10(12)13-9(6)4-8/h1-5H
InChI Key:	OUKVZDXSWJHLNI-UHFFFAOYSA-N
Boiling Point:	389.8 °C at 760 mmHg
Density:	1.727 g/cm³
LogP:	3.46320

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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
[203506-30-3]C11H12N2O
2-Amino-6-methoxy-3-methylquinoline
[91092-92-1]C11H9NO4
3-Carbomethoxy-1,2,3,4-tetrahydroisoquinoline-1,4-dione
[927800-47-3]C10H4Cl4FN
4-Chloro-6-fluoro-2-trichloromethyl-quinoline
[30740-95-5]C12H16ClNO4
6,7-Dimethoxy-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid hydrochloride

GHS Hazard Statement:	H301 (97.44%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P264, P270, P301+P310, P321, P330, P405, and P501
Signal Word:	Danger

Publication Number	Title	Priority Date
WO-2021126999-A1	Use of biomarkers in identifying patients that will be responsive to treatment with a prmt5 inhibitor	20191217
WO-2020243178-A1	Heterocyclic compounds as prmt5 inhibitors	20190530
WO-2020033282-A1	Prmt5 inhibitors	20180807
WO-2020033288-A1	Prmt5 inhibitors	20180807
AU-2019317549-A1	PRMT5 inhibitors	20180807

Complexity:	226
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	268.92430
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	268.92430
Rotatable Bond Count:	1
Topological Polar Surface Area:	30 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.3