4-METHOXYPHENYL ISOTHIOCYANATE

4-METHOXYPHENYL ISOTHIOCYANATE Basic information

Product Name:	4-METHOXYPHENYL ISOTHIOCYANATE
Synonyms:	TIMTEC-BB SBB006547;P-METHOXYPHENYL ISOTHIOCYANATE;1-ISOTHIOCYANATO-4-METHOXYBENZENE;AKOS BBS-00004436;4-METHOXYPHENYL ISOTHIOCYANATE;4-ISOTHIOCYANATOANISOLE;ISOTHIOCYANIC ACID 4-METHOXYPHENYL ESTER;Benzene, 1-isothiocyanato-4-methoxy-
CAS:	2284-20-0
MF:	C8H7NOS
MW:	165.21
EINECS:	218-921-3
Product Categories:	Pyridines;Organic Building Blocks;Sulfur Compounds;Thiocyanates/Isothiocyanates
Mol File:	2284-20-0.mol

4-METHOXYPHENYL ISOTHIOCYANATE Chemical Properties

Melting point	18 °C(lit.)
Boiling point	280-281 °C(lit.)
density	1.196 g/mL at 25 °C(lit.)
refractive index	n20/D 1.653(lit.)
Fp	>230 °F
storage temp.	Store below +30°C.
form	powder to lump to clear liquid
color	White or Colorless to Yellow
Specific Gravity	1.196
Water Solubility	It hydrolyzes in water.
Sensitive	Moisture Sensitive
BRN	606967
InChIKey	VRPQCVLBOZOYCG-UHFFFAOYSA-N
LogP	3.580
CAS DataBase Reference	2284-20-0(CAS DataBase Reference)

Safety Information

MSDS Information

4-METHOXYPHENYL ISOTHIOCYANATE Usage And Synthesis

Chemical Properties	clear yellow liquid after melting
Uses	4-Methoxyphenyl isothiocyanate has been used in the synthesis of 3-benzyl-2-(4-methoxyphenyl)-3H-[1,2,4]triazolo-[5,1-b]quinazolin-9-one and 2-{[4-amino-3-(4-methylphenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]acetyl}-N-arylhydrazinecarbothioamides.
Synthesis Reference(s)	Tetrahedron Letters, 38, p. 1597, 1997 DOI: 10.1016/S0040-4039(97)00121-4

4-METHOXYPHENYL ISOTHIOCYANATE Preparation Products And Raw materials

Raw materials	Carbonocyanidothioicamide, N-(4-methoxyphenyl)--->N-HYDROXY-4-METHOXYBENZENECARBOXIMIDOYL CHLORIDE-->4-METHOXYPHENYL ISOCYANIDE-->Carbon disulfide-->(Trifluoromethyl)trimethylsilane-->Thiophosgene-->p-Anisidine
Preparation Products	5-(2-METHOXYPHENYL)-4-(4-METHOXYPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL-->N-BENZYL-6-METHOXY-1,3-BENZOTHIAZOL-2-AMINE

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