2,6-Dichloroquinoline-3-carboxaldehyde - CAS 73568-41-9

Catalog:	BB034873
Product Name:	2,6-Dichloroquinoline-3-carboxaldehyde
CAS:	73568-41-9
Synonyms:	2,6-dichloroquinoline-3-carbaldehyde

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Computed Properties

IUPAC Name:	2,6-dichloroquinoline-3-carbaldehyde
Description:	2,6-Dichloroquinoline-3-carboxaldehyde (CAS# 73568-41-9) is a useful research chemical.
Molecular Weight:	226.06
Molecular Formula:	C10H5Cl2NO
Canonical SMILES:	C1=CC2=NC(=C(C=C2C=C1Cl)C=O)Cl
InChI:	InChI=1S/C10H5Cl2NO/c11-8-1-2-9-6(4-8)3-7(5-14)10(12)13-9/h1-5H
InChI Key:	WZUNMOMEOMPYKZ-UHFFFAOYSA-N
Boiling Point:	357.5 °C at 760 mmHg
Purity:	95 %
Density:	1.483 g/cm³
LogP:	3.35410

Publication Number	Title	Priority Date
CN-113214182-A	Benzisothiazole compound and preparation method thereof	20210519
US-2020206233-A1	Heterocyclic compounds as mutant idh inhibitors	20181231
WO-2020141439-A1	Heterocyclic compounds as mutant idh inhibitors	20181231
US-10532047-B2	Solid forms of ((S)-5-((1-(6-chloro-2-oxo-1,2-dihydroquinolin-3-yl)ethyl)amino)-1-methyl-6-oxo-1,6-dihydropyridine-2-carbonitrile	20180516
US-2019350919-A1	Inhibiting mutant idh-1	20180516

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Related Functional Groups

Quinoline/Isoquinoline

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[361982-79-8]
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[36034-54-5]
4-Methoxyisoquinoline
[19490-87-0]
7-Methoxy-2-methylquinoline
[1394843-51-6]
3-Hydroxy-1-methyl-6-nitroquinolin-2(1H)-one
[179943-57-8]
Ethyl 7-Bromo-4-hydroxy-3-quinolinecarboxylate

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GHS Hazard Statement:	H302 (97.44%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, and P501
Signal Word:	Warning

Complexity:	224
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	224.9748192
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	224.9748192
Rotatable Bond Count:	1
Topological Polar Surface Area:	30 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.2