5-Chloro-2-hydroxy-3-methoxybenzaldehyde - CAS 7740-05-8

Catalog:	BB035926
Product Name:	5-Chloro-2-hydroxy-3-methoxybenzaldehyde
CAS:	7740-05-8
Synonyms:	5-chloro-2-hydroxy-3-methoxybenzaldehyde

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	5-chloro-2-hydroxy-3-methoxybenzaldehyde
Description:	5-Chloro-2-hydroxy-3-methoxybenzaldehyde (CAS# 7740-05-8) is a useful research chemical compound.
Molecular Weight:	186.59
Molecular Formula:	C8H7ClO3
Canonical SMILES:	COC1=C(C(=CC(=C1)Cl)C=O)O
InChI:	InChI=1S/C8H7ClO3/c1-12-7-3-6(9)2-5(4-10)8(7)11/h2-4,11H,1H3
InChI Key:	PQKYPMGTDHNSRL-UHFFFAOYSA-N
Boiling Point:	268 °C at 760 mmHg
Density:	1.377 g/cm³
MDL:	MFCD01103568
LogP:	1.86670

Publication Number	Title	Priority Date
WO-2021191882-A1	Antimalarial agent, methods and uses thereof	20200327
CN-108727176-B	Method for preparing 5-halogen-2, 3-dihydroxy benzaldehyde	20180726
EP-3645007-A1	Methods of treating cancer with small molecule nf-kb inhibitors	20170627
US-2019000851-A1	METHODS OF TREATING CANCER WITH SMALL MOLECULE NF-kB INHIBITORS	20170627
WO-2019006002-A1	METHODS OF TREATING CANCER USING SMALL MOLECULE TYPE NF-KB INHIBITORS	20170627

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Related Functional Groups

Carbonyl Compounds

[70199-62-1]
(4-Pyridyl)acetone Hydrochloride
[35153-16-3]
(Z)-10-Tetradecenyl Acetate
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	162
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	186.0083718
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	186.0083718
Rotatable Bond Count:	2
Topological Polar Surface Area:	46.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2