6-methyl thiohexyl isothiocyanate

Modify Date: 2025-08-25 11:00:24

6-methyl thiohexyl isothiocyanate Structure
6-methyl thiohexyl isothiocyanate structure
Common Name 6-methyl thiohexyl isothiocyanate
CAS Number 4430-39-1 Molecular Weight 189.34100
Density 1g/cm3 Boiling Point 284.6ºC at 760 mmHg
Molecular Formula C8H15NS2 Melting Point N/A
MSDS N/A Flash Point 125.9ºC

 Names

Name 1-isothiocyanato-6-methylsulfanylhexane
Synonym More Synonyms

 Chemical & Physical Properties

Density 1g/cm3
Boiling Point 284.6ºC at 760 mmHg
Molecular Formula C8H15NS2
Molecular Weight 189.34100
Flash Point 125.9ºC
Exact Mass 189.06500
PSA 69.75000
LogP 3.01260
Index of Refraction 1.522
InChIKey YIBXPFAXPUDDTK-UHFFFAOYSA-N
SMILES CSCCCCCCN=C=S

 Safety Information

HS Code 2930909090

 Synthetic Route

~94%

6-methyl thiohexyl isothiocyanate Structure

6-methyl thiohe...

CAS#:4430-39-1

Literature: Shmakov, V. S.; Biktimirova, L. A.; Tolstikova, O. V.; Vyrypaev, E. M.; Furlei, I. I.; Tolstikov, A. G. Doklady Chemistry, 1993 , vol. 332, # 1-3 p. 202 - 205 Dokl. Akad. Nauk SSSR Ser. Khim., 1993 , vol. 332, # 2 p. 203 - 206

~%

6-methyl thiohexyl isothiocyanate Structure

6-methyl thiohe...

CAS#:4430-39-1

Literature: Noshita, Toshiro; Kidachi, Yumi; Funayama, Hirokazu; Kiyota, Hiromasa; Yamaguchi, Hideaki; Ryoyama, Kazuo European Journal of Medicinal Chemistry, 2009 , vol. 44, # 12 p. 4931 - 4936

~%

6-methyl thiohexyl isothiocyanate Structure

6-methyl thiohe...

CAS#:4430-39-1

Literature: Holland, Herbert L.; Brown, Frances M.; Larsen, Brett G.; Zabic, Mirjana Tetrahedron: Asymmetry, 1995 , vol. 6, # 7 p. 1569 - 1574

~%

6-methyl thiohexyl isothiocyanate Structure

6-methyl thiohe...

CAS#:4430-39-1

Literature: Holland, Herbert L.; Brown, Frances M.; Larsen, Brett G.; Zabic, Mirjana Tetrahedron: Asymmetry, 1995 , vol. 6, # 7 p. 1569 - 1574

~%

6-methyl thiohexyl isothiocyanate Structure

6-methyl thiohe...

CAS#:4430-39-1

Literature: Kjaer; Christensen Acta Chemica Scandinavica (1947-1973), 1957 , vol. 11, p. 1298,1300,1305

~%

6-methyl thiohexyl isothiocyanate Structure

6-methyl thiohe...

CAS#:4430-39-1

Literature: Kjaer; Christensen Acta Chemica Scandinavica (1947-1973), 1957 , vol. 11, p. 1298,1300,1305

~%

6-methyl thiohexyl isothiocyanate Structure

6-methyl thiohe...

CAS#:4430-39-1

Literature: Kjaer; Christensen Acta Chemica Scandinavica (1947-1973), 1957 , vol. 11, p. 1298,1300,1305

~%

6-methyl thiohexyl isothiocyanate Structure

6-methyl thiohe...

CAS#:4430-39-1

Literature: Kjaer; Christensen Acta Chemica Scandinavica (1947-1973), 1957 , vol. 11, p. 1298,1300,1305

 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

6-Methylmercapto-hexylisothiocyanat
6-isothiocyanatohexyl methyl sulfide
6-methylthiohexyl isothiocyanate
6-methylsulfanyl-hexyl isothiocyanate
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