CAS No.2362-64-3,4-METHOXYTHIOBENZAMIDE Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	2362-64-3
Name:	4-METHOXYTHIOBENZAMIDE
Article Data:	56

Formula:	C₈H₉NOS
Molecular Weight:	167.232
Synonyms:	p-Anisamide,thio- (6CI,7CI,8CI);4-Methoxybenzenecarbothioamide;4-Methoxybenzothioamide;4-Methoxythiobenzamide;Thio-p-anisamide;p-Methoxybenzothiamide;p-Methoxythiobenzamide;
Density:	1.194 g/cm³
Melting Point:	145-149 °C
Boiling Point:	288.5 °C at 760 mmHg
Flash Point:	128.3 °C
Appearance:	yellow powder
Hazard Symbols:	Xi
Risk Codes:	43
Safety:	36
PSA:	67.34000
LogP:	2.02970

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Specification

The Benzenecarbothioamide,4-methoxy-, with the CAS registry number 2362-64-3, is also known as Thio-p-anisamide. It belongs to the product categories of Organic Building Blocks; Sulfur Compounds; Thiocarbonyl Compounds. This chemical's molecular formula is C₈H₉NOS and molecular weight is 167.23. Its systematic name is called 4-methoxybenzenecarbothioamide. This chemical is yellow powder.

Physical properties of Benzenecarbothioamide,4-methoxy-: (1)ACD/LogP: 1.63; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.63; (4)ACD/LogD (pH 7.4): 1.63; (5)ACD/BCF (pH 5.5): 10.12; (6)ACD/BCF (pH 7.4): 10.12; (7)ACD/KOC (pH 5.5): 182.46; (8)ACD/KOC (pH 7.4): 182.47; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Index of Refraction: 1.619; (13)Molar Refractivity: 49.12 cm³; (14)Molar Volume: 140 cm³; (15)Surface Tension: 54.1 dyne/cm; (16)Density: 1.194 g/cm³; (17)Flash Point: 128.3 °C; (18)Enthalpy of Vaporization: 52.77 kJ/mol; (19)Boiling Point: 288.5 °C at 760 mmHg; (20)Vapour Pressure: 0.00233 mmHg at 25°C.

Preparation: this chemical can be prepared by 4-methoxy-benzonitrile. This reaction will need reagent H₂S, triethanolamine and solvent ethanol.

Uses of Benzenecarbothioamide,4-methoxy-: it can be used to produce 2-(4-methoxy-phenyl)-thiazole. This reaction will need reagent aq.-ethanolic HCl.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It may cause sensitisation by skin contact. Whenever you will contact it, please wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1)SMILES: S=C(c1ccc(OC)cc1)N
(2)InChI: InChI=1/C8H9NOS/c1-10-7-4-2-6(3-5-7)8(9)11/h2-5H,1H3,(H2,9,11)
(3)InChIKey: WKWVTPKUHJOVTI-UHFFFAOYAW