Thiocyanic acid,(3-methylphenyl)methyl ester

Modify Date: 2025-09-26 12:25:01

Thiocyanic acid,(3-methylphenyl)methyl ester Structure
Thiocyanic acid,(3-methylphenyl)methyl ester structure
Common Name Thiocyanic acid,(3-methylphenyl)methyl ester
CAS Number 37141-50-7 Molecular Weight 163.23900
Density 1.119g/cm3 Boiling Point 274.8ºC at 760mmHg
Molecular Formula C9H9NS Melting Point N/A
MSDS N/A Flash Point 120ºC

 Names

Name 3-Methylbenzyl thiocyanate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.119g/cm3
Boiling Point 274.8ºC at 760mmHg
Molecular Formula C9H9NS
Molecular Weight 163.23900
Flash Point 120ºC
Exact Mass 163.04600
PSA 49.09000
LogP 2.70928
Index of Refraction 1.579
InChIKey NSGWUGKMTAEVPQ-UHFFFAOYSA-N
SMILES Cc1cccc(CSC#N)c1

 Safety Information

HS Code 2930909090

 Synthetic Route

~92%

Thiocyanic acid,(3-methylphenyl)methyl ester Structure

Thiocyanic acid...

CAS#:37141-50-7

Literature: Kodomari, Mitsuo; Kuzuoka, Tetsuo; Yoshitomi, Suehiko Synthesis, 1983 , # 2 p. 141 - 142

~83%

Thiocyanic acid,(3-methylphenyl)methyl ester Structure

Thiocyanic acid...

CAS#:37141-50-7

Literature: Kiasat, Ali Reza; Nazari, Simin Journal of Molecular Catalysis A: Chemical, 2012 , vol. 365, p. 80 - 86

~84%

Thiocyanic acid,(3-methylphenyl)methyl ester Structure

Thiocyanic acid...

CAS#:37141-50-7

Literature: Kiasat, Ali Reza; Nazari, Simin Journal of Inclusion Phenomena and Macrocyclic Chemistry, 2013 , vol. 76, # 3-4 p. 363 - 368

~%

Thiocyanic acid,(3-methylphenyl)methyl ester Structure

Thiocyanic acid...

CAS#:37141-50-7

Literature: Wheeler; Johnson American Chemical Journal, 1901 , vol. 26, p. 202

~%

Thiocyanic acid,(3-methylphenyl)methyl ester Structure

Thiocyanic acid...

CAS#:37141-50-7

Literature: v.Braun; May; Michaelis Justus Liebigs Annalen der Chemie, 1931 , vol. 490, p. 189,200

~%

Thiocyanic acid,(3-methylphenyl)methyl ester Structure

Thiocyanic acid...

CAS#:37141-50-7

Literature: Bacon,R.G.R.; Guy,R.G. Journal of the Chemical Society, 1961 , p. 2428 - 2436

~%

Thiocyanic acid,(3-methylphenyl)methyl ester Structure

Thiocyanic acid...

CAS#:37141-50-7

Literature: Bacon,R.G.R.; Guy,R.G. Journal of the Chemical Society, 1961 , p. 2428 - 2436

 Customs

HS Code 2930909090
Summary 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

 Synonyms

(3-methylphenyl)methyl thiocyanate
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