31088-81-0

31088-81-0 structure
31088-81-0 structure
  • Name: 1-tert-Butyl-4-isothiocyanatomethylbenzene
  • Chemical Name: 1-tert-butyl-4-(isothiocyanatomethyl)benzene
  • CAS Number: 31088-81-0
  • Molecular Formula: C12H15NS
  • Molecular Weight: 205.31900
  • Create Date: 2018-08-29 23:12:21
  • Modify Date: 2024-01-07 12:06:19

Name 1-tert-butyl-4-(isothiocyanatomethyl)benzene
Synonyms 4-t-BuPhCH2NCS
para-tbutylbenzyl-isothiocyanate
1-tert-Butyl-4-isothiocyanatomethyl-benzene
A5644
1-tert-butyl-4-isothiocyanomethyl benzene
4-t-butylbenzyl isothiocyanate
4-tert-Butylbenzyl isothiocyanate
1-tert-Butyl-4-isothiocyanatomethylbenzene
Density 0.96
Boiling Point 296.2ºC at 760 mmHg
Molecular Formula C12H15NS
Molecular Weight 205.31900
Flash Point 137.1ºC
Exact Mass 205.09300
PSA 44.45000
LogP 3.58690
Index of Refraction 1.527
HS Code 2930909090

~68%

31088-81-0 structure

31088-81-0

Literature: Suh, Young Ger; Oh, Uh Taek; Kim, Hee Doo; Lee, Jee Woo; Park, Hyeung Geun; Park, Ok Hui; Lee, Yong Sil; Park, Young Ho; Joo, Yung Hyup; Choi, Jin Kyu; Lim, Kyung Min; Kim, Sun Young; Kim, Jin Kwan; Koh, Hyun Ju; Moh, Joo Hyun; Jeong, Yeon Su; Yi, Jung Bum; Oh, Young Im Patent: US2003/153596 A1, 2003 ;

~67%

31088-81-0 structure

31088-81-0

Literature: Wrigglesworth, Roger; Walpole, Christopher S. J.; Bevan, Stuart; Campbell, Elizabeth A.; Dray, Andy; Hughes, Glyn A.; James, Iain; Masdin, Kay J.; Winter, Janet Journal of Medicinal Chemistry, 1996 , vol. 39, # 25 p. 4942 - 4951
Precursor  3

DownStream  0

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%