4-Chloro-2-methoxyphenol - CAS 16766-30-6

Catalog:	BB012408
Product Name:	4-Chloro-2-methoxyphenol
CAS:	16766-30-6
Synonyms:	Phenol, 4-chloro-2-methoxy-; 2-Methoxy-4-chloro-phenol

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Computed Properties

IUPAC Name:	4-chloro-2-methoxyphenol
Description:	4-Chloro-2-methoxyphenol is used as a reagent in the synthesis of novel potent and selective sphingosine-1-phosphate 4 receptor (S1P4-R) agonists which may be used in development of treatment against autoimmue diseases and viral infections.
Molecular Weight:	158.58
Molecular Formula:	C7H7ClO2
Canonical SMILES:	COC1=C(C=CC(=C1)Cl)O
InChI:	InChI=1S/C7H7ClO2/c1-10-7-4-5(8)2-3-6(7)9/h2-4,9H,1H3
InChI Key:	FVZQMMMRFNURSH-UHFFFAOYSA-N
Boiling Point:	241 ℃ (lit.)
Density:	1.28 g/cm³
MDL:	MFCD00070774
LogP:	2.05420

Publication Number	Title	Priority Date
CN-112480182-A	Preparation method of low-molecular-weight lignin and application of low-molecular-weight lignin in preparation of monophenol compounds	20201222
CN-111454132-A	Method for synthesizing eugenol	20200331
CN-111454133-A	Synthesis method of eugenol	20200331
CN-111620764-A	Selective ether bond breaking method of aryl alkyl ether	20200324
CN-113195505-A	Inhibitors of metallo-beta-lactamase produced by multi-drug resistant bacteria and methods of preparing the same	20191121

PMID	Publication Date	Title	Journal
20099623	20091201	Degradation of 4-chloroguaiacol by dark Fenton and solar photo-Fenton advanced oxidation processes	Water environment research : a research publication of the Water Environment Federation
16844292	20061201	Electrochemical degradation of 4-chloroguaiacol for wastewater treatment using PbO2 anodes	Journal of hazardous materials
18970563	20060315	Amperometric determination of chloroguaiacol at submicromolar levels after on-line preconcentration with molecularly imprinted polymers	Talanta

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Related Functional Groups

Oxygen Compounds

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[1281984-38-0]
1-Cyclopentyl-3,5-dinitro-1H-pyrazole
[1170836-25-5]
1-Cyclopentyl-5-nitro-1H-pyrazole
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[1011396-69-2]
2,2-Difluoro-N-(4-methoxy-3-(methoxymethyl)benzyl)ethanamine

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GHS Hazard Statement:	H302 (11.36%): 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

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 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.5