6-chloropyridine-2-carbaldehyde - CAS 54087-03-5

Name: 6-chloropyridine-2-carbaldehyde
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB028494
Product Name:	6-chloropyridine-2-carbaldehyde
CAS:	54087-03-5
Synonyms:	6-chloro-2-pyridinecarboxaldehyde; 6-chloropyridine-2-carbaldehyde

Technical Data

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Computed Properties

IUPAC Name:	6-chloropyridine-2-carbaldehyde
Description:	6-chloropyridine-2-carbaldehyde (CAS# 54087-03-5) is a useful research chemical.
Molecular Weight:	141.56
Molecular Formula:	C6H4ClNO
Canonical SMILES:	C1=CC(=NC(=C1)Cl)C=O
InChI:	InChI=1S/C6H4ClNO/c7-6-3-1-2-5(4-9)8-6/h1-4H
InChI Key:	XTRLIKXVRGWTKW-UHFFFAOYSA-N
Boiling Point:	218.969 °C at 760 mmHg
Melting Point:	68-69 °C
Purity:	98 %
Density:	1.332 g/cm³
Appearance:	White to off-white solid
MDL:	MFCD09832941
LogP:	1.54750

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Related Functional Groups

Pyridines

[149463-07-0]C6H6Cl2FN
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[63585-69-3]C6H7ClN2O2
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[1198098-45-1]C11H12N2
3-Allyl-5-methyl-1H-pyrrolo[2,3-b]pyridine
[1122-43-6]C7H9NO
3-Hydroxy-2,6-dimethylpyridine
[2092299-60-8]C9H7ClN2
6-Chloro-3-cyclopropylpicolinonitrile
[86847-84-9]C10H13ClN2O
N-(6-Chloro-pyridin-2-yl)-2,2-dimethyl-propionamide

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GHS Hazard Statement:	H302 (90%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
WO-2021119265-A1	Antagonists of the muscarinic acetylcholine receptor m4	20191210
CN-110590650-A	Synthetic method of 6- (methylsulfonyl) pyridine formaldehyde	20190924
WO-2020221811-A1	Novel oxalyl piperazines active against the hepatitis b virus (hbv)	20190430
WO-2020221824-A1	Novel indolizine-2-carboxamides active against the hepatitis b virus (hbv)	20190430
TW-202106678-A	Novel oxalyl piperazines active against the hepatitis b virus (hbv)	20190430

Complexity:	107
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	140.9981414
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	140.9981414
Rotatable Bond Count:	1
Topological Polar Surface Area:	30 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.6