2-Chloro-6-methoxybenzaldehyde - CAS 29866-54-4

Catalog:	BB020348
Product Name:	2-Chloro-6-methoxybenzaldehyde
CAS:	29866-54-4
Synonyms:	2-chloro-6-methoxybenzaldehyde; 2-chloro-6-methoxybenzaldehyde

Technical Data

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Computed Properties

IUPAC Name:	2-chloro-6-methoxybenzaldehyde
Description:	2-Chloro-6-methoxybenzaldehyde (CAS# 29866-54-4) is a useful research chemical.
Molecular Weight:	170.59
Molecular Formula:	C8H7ClO2
Canonical SMILES:	COC1=C(C(=CC=C1)Cl)C=O
InChI:	InChI=1S/C8H7ClO2/c1-11-8-4-2-3-7(9)6(8)5-10/h2-5H,1H3
InChI Key:	UHXUZNJCLHADGD-UHFFFAOYSA-N
Boiling Point:	263.089 °C at 760 mmHg
Density:	1.245 g/cm³
MDL:	MFCD08059233
LogP:	2.16110

Publication Number	Title	Priority Date
CN-110606855-A	Polysubstituted benzothienoisoquinoline, derivative and synthesis method thereof	20190711
WO-2020249064-A1	Compounds for modulating fxr	20190614
KR-20190015731-A	Sulfonamide compounds or salts thereof	20160531
TW-201729811-A	Antitumor effect enhancer derived from pyrrolopyrimidine compound	20151222
AU-2016270751-A1	2-(phenyloxy or phenylthio)pyrimidine derivatives as herbicides	20150605

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Related Functional Groups

Carbonyl Compounds

[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[1016519-61-1]
2-(Methyl-2-pyridylamino)acetic Acid
[151585-93-2]
2-Amino-6-fluorobenzaldehyde
[113366-46-4]
2-Ethyl-4-methyl-1,3-thiazole-5-carboxylic acid
[871126-22-6]
2-Fluoro-4-formylphenylboronic acid

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	138
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	170.0134572
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	170.0134572
Rotatable Bond Count:	2
Topological Polar Surface Area:	26.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2