ChemicalBook Product Catalog Chemical Reagents Organic reagents Thiol / thiol 2-Methoxybenzenethiol

2-Methoxybenzenethiol

Product Name2-Methoxybenzenethiol
CAS7217-59-6
MFC7H8OS
MW140.2
EINECS230-605-7
MOL File7217-59-6.mol

Chemical Properties

Melting point	306.7-313.7 °C (decomp)
Boiling point	99 °C/8 mmHg (lit.)
Density	1.152 g/mL at 25 °C (lit.)
FEMA	4159 \| 2-MERCAPTOANISOLE
refractive index	n20/D 1.591(lit.)
Flash point	204 °F
storage temp.	under inert gas (nitrogen or Argon) at 2-8°C
solubility	H2O: insoluble
pka	6.62±0.43(Predicted)
form	Liquid
Specific Gravity	1.152
color	Clear yellow
Odor	at 1.00 % in propylene glycol. meaty smoked sausage powdery sweet spicy phenolic sulfurous
Odor Type	meaty
biological source	synthetic
Water Solubility	H2O: insoluble alcohol: soluble
Sensitive	Stench
JECFA Number	1666
BRN	2042178
Stability	Moisture Sensitive
Major Application	flavors and fragrances
InChI	1S/C7H8OS/c1-8-6-4-2-3-5-7(6)9/h2-5,9H,1H3
InChIKey	DSCJETUEDFKYGN-UHFFFAOYSA-N
SMILES	COc1ccccc1S
LogP	204.00 °F. TCC
CAS DataBase Reference	7217-59-6(CAS DataBase Reference)
EPA Substance Registry System	Benzenethiol, 2-methoxy- (7217-59-6)

Safety Information

Hazard Codes	Xn,Xi
Risk Statements	22-36/37/38
Safety Statements	26-36/37-37/39
RIDADR	3334
WGK Germany	3
RTECS	DC1790000
F	10-13-23
Hazard Note	Harmful/Stench
TSCA	TSCA listed
HazardClass	IRRITANT, STENCH
HS Code	29309090
Storage Class	10 - Combustible liquids
Hazard Classifications	Acute Tox. 4 Oral Eye Irrit. 2 Skin Irrit. 2 STOT SE 3

MSDS

Provider	Language
ACROS	English
SigmaAldrich	English
ALFA	English

Usage And Synthesis

Chemical Properties

Colorless to yellowish liquid; pungent, onion aroma.

Chemical Properties

clear yellow liquid

Occurrence

Reported found in coffee.

Uses

2-Methoxythiophenol is used in the synthesis of berberine-thiophenyl hybrids as multifunctional agents. Inhibition of acetylcholinesterase, butyrylcholinesterase and AB aggregation antioxidant activity.

Uses

2-Methoxythiophenol was used in the synthesis of:

(4S)-N-[(2S)-2-methy-3-(2-methoxyphenylthio)propanoyl]-4-phenyloxazolidin-2-one
2-(4-fluorophenyl)-6-(2-methoxyphenylsulfanyl)imidazo[1,2-a]pyridine
2-(2-methoxyphenylsulfanyl)benzoic acid

Definition

ChEBI: 2-Methoxybenzenethiol is a thiol.

Aroma threshold values

Meaty type, very high strength odor, recommend smelling in a 0.10% solution or less.

Taste threshold values

Meaty sausage taste at 1 ppm in water.

General Description

2-Methoxythiophenol is a sulfur-containing compound that can be used as a flavoring agent.

Synthesis

2-Methoxybenzenethiol is prepared：
1) from or(ho-Aminophenol-methylether via Diazoreaction.
2) from Sodium phenoxide plus Sulfur at 200° C. to yield 2: 2'-Dihydroxy-diphenyldisulfide. Reduction and Methylation afford the title ether.

2-Methoxybenzenethiol

Chemical Properties

Safety Information

MSDS

Usage And Synthesis

Preparation Products And Raw materials

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