4-Bromo-6-chloronicotinaldehyde - CAS 1060805-64-2

Catalog:	BB001782
Product Name:	4-Bromo-6-chloronicotinaldehyde
CAS:	1060805-64-2
Synonyms:	4-bromo-6-chloro-3-pyridinecarboxaldehyde; 4-bromo-6-chloropyridine-3-carbaldehyde

Technical Data

Patents

Computed Properties

IUPAC Name:	4-bromo-6-chloropyridine-3-carbaldehyde
Description:	4-Bromo-6-chloronicotinaldehyde (CAS# 1060805-64-2 ) is a useful research chemical.
Molecular Weight:	220.45
Molecular Formula:	C6H3BrClNO
Canonical SMILES:	C1=C(C(=CN=C1Cl)C=O)Br
InChI:	InChI=1S/C6H3BrClNO/c7-5-1-6(8)9-2-4(5)3-10/h1-3H
InChI Key:	VIRJSSSWMBEHAG-UHFFFAOYSA-N
Storage:	Inert atmosphere, 2-8 °C
LogP:	2.31000

Publication Number	Title	Priority Date
CN-109651241-B	Synthesis method of 4-bromo-6-chloronicotinaldehyde	20181227
AU-2013249041-A1	Benzothiazol- 6 -yl acetic acid derivatives and their use for treating an HIV infection	20120420
AU-2013249041-B2	Benzothiazol- 6 -yl acetic acid derivatives and their use for treating an HIV infection	20120420
AU-2017200619-A1	Benzothiazol-6-yl acetic acid derivatives and their use for treating an HIV infection	20120420
EP-2788336-A1	Benzothiazol- 6 -yl acetic acid derivatives and their use for treating an hiv infection	20120420

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Complexity:	133
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	218.90865
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	218.90865
Rotatable Bond Count:	1
Topological Polar Surface Area:	30
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2