5-Chloro-2-methoxyphenol - CAS 3743-23-5

Catalog:	BB050285
Product Name:	5-Chloro-2-methoxyphenol
CAS:	3743-23-5
Synonyms:	Phenol, 5-chloro-2-methoxy-; 4-Chloro-2-hydroxyanisole; 5-chloro-2-methoxy-phenol

Technical Data

Safety and Hazards

Computed Properties

IUPAC Name:	5-chloro-2-methoxyphenol
Description:	5-Chloro-2-methoxyphenol (CAS# 3743-23-5 ) is a useful research chemical.
Molecular Weight:	158.58
Molecular Formula:	C7H7ClO2
Canonical SMILES:	COC1=C(C=C(C=C1)Cl)O
InChI:	InChI=1S/C7H7ClO2/c1-10-7-3-2-5(8)4-6(7)9/h2-4,9H,1H3
InChI Key:	HIWHLFQMDDWLRB-UHFFFAOYSA-N
Boiling Point:	237.7 °C at 760 mmHg
Density:	1.28 g/cm³

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Related Functional Groups

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Arenes

[1018141-88-2]
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Methyl 3-chloro-2-hydroxybenzoate
[843673-72-3]
(R)-4-(1-((tert-Butoxycarbonyl)amino)-2-hydroxyethyl)phenyl trifluoromethanesulfonate
[605-02-7]
1-Phenylnaphthalene

Halides

[1855911-19-1]
1-(4-Bromo-2-ethylpyrazol-3-yl)-N-methylmethanamine hydrochloride
[832741-29-4]
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[932890-93-2]
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[199114-62-0]
2-(Chloromethyl)-3-methylquinazolin-4(3H)-one
[73084-03-4]
2,4-di-tert-butyl-6-chloro-1,3,5-triazine
[4185-62-0]
2-Bromo-1-nitronaphthalene

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Precautionary Statement:	P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, and P501
Signal Word:	Danger

Complexity:	108
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	158.0134572
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	158.0134572
Rotatable Bond Count:	1
Topological Polar Surface Area:	29.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.1