3-Bromo-5-chloro-4-hydroxybenzaldehyde - CAS 1849-76-9

Catalog:	BB014176
Product Name:	3-Bromo-5-chloro-4-hydroxybenzaldehyde
CAS:	1849-76-9
Synonyms:	3-bromo-5-chloro-4-hydroxybenzaldehyde

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	3-bromo-5-chloro-4-hydroxybenzaldehyde
Description:	3-Bromo-5-chloro-4-hydroxybenzaldehyde (CAS# 1849-76-9) is a useful research chemical.
Molecular Weight:	235.46
Molecular Formula:	C7H4BrClO2
Canonical SMILES:	C1=C(C=C(C(=C1Cl)O)Br)C=O
InChI:	InChI=1S/C7H4BrClO2/c8-5-1-4(3-10)2-6(9)7(5)11/h1-3,11H
InChI Key:	ITSXSHQWMYYQQY-UHFFFAOYSA-N
Boiling Point:	264.7 °C at 760 mmHg
Purity:	95 %
Density:	1.844 g/cm³
LogP:	2.62060

Publication Number	Title	Priority Date
JP-2019043948-A	Malignant tumor therapeutic agent containing 5-methyl-6-phenyl-4,5-dihydro-2H-pyridazin-3-one derivative	20170901
BR-102016024810-A2	Curcumin application as biodiesel stabilizer	20161024
CN-106124646-A	A kind of detect the method for polarity phenol chloro/bromo disinfection byproduct (DBP) in water	20160612
AU-2017226674-A1	5-methyl-6-phenyl-4,5-dihydro-2h-pyridazin-3-one derivative	20160304
CA-3015331-A1	5-methyl-6-phenyl-4,5-dihydro-2h-pyridazin-3-one derivative	20160304

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Related Functional Groups

Carbonyl Compounds

[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[55441-25-3]
1-(2-Cyanophenyl)urea
[1431966-64-1]
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride
[2168559-63-3]
2-(6-Methyl-2-pyridyl)acetic Acid Hydrochloride
[927676-51-5]
2-(6-Bromo-3-indolyl)-2-oxoacetic Acid
[438616-66-1]
2-(4-Tert-Butylphenyl)cyclopropanecarbohydrazide

GHS Hazard Statement:	H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P264, P270, P301+P310, P321, P330, P405, and P501
Signal Word:	Danger

Complexity:	153
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	233.90832
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	233.90832
Rotatable Bond Count:	1
Topological Polar Surface Area:	37.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.3