3, 4-Dihydrobenzo[f][1, 4]thiazepin-5(2H)-one

Modify Date: 2024-01-03 12:49:55

3, 4-Dihydrobenzo[f][1, 4]thiazepin-5(2H)-one Structure
3, 4-Dihydrobenzo[f][1, 4]thiazepin-5(2H)-one structure
Common Name 3, 4-Dihydrobenzo[f][1, 4]thiazepin-5(2H)-one
CAS Number 14944-00-4 Molecular Weight 179.23900
Density 1.228 g/cm3 Boiling Point 420.656ºC at 760 mmHg
Molecular Formula C9H9NOS Melting Point N/A
MSDS N/A Flash Point 208.206ºC

 Names

Name 3,4-dihydro-2H-1,4-benzothiazepin-5-one
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.228 g/cm3
Boiling Point 420.656ºC at 760 mmHg
Molecular Formula C9H9NOS
Molecular Weight 179.23900
Flash Point 208.206ºC
Exact Mass 179.04000
PSA 57.89000
LogP 1.53250

 Safety Information

Hazard Codes Xn
Risk Phrases 22;36/37/38
Safety Phrases 22;26;36/37/39
HS Code 2934999090

 Synthetic Route

~%

3, 4-Dihydrobenzo[f][1, 4]thiazepin-5(2H)-one Structure

3, 4-Dihydroben...

CAS#:14944-00-4

Literature: F. HOFFMANN-LA ROCHE AG; LIANG, Chungen; WANG, Lisha; YUN, Hongying Yun; ZHENG, Xiufang Patent: WO2013/53658 A1, 2013 ; Location in patent: Page/Page column 15-16 ;

~44%

3, 4-Dihydrobenzo[f][1, 4]thiazepin-5(2H)-one Structure

3, 4-Dihydroben...

CAS#:14944-00-4

Literature: Ishibashi, Hiroyuki; Uegaki, Masayuki; Sakai, Manami; Takeda, Yoshifumi Tetrahedron, 2001 , vol. 57, # 11 p. 2115 - 2120

~%

3, 4-Dihydrobenzo[f][1, 4]thiazepin-5(2H)-one Structure

3, 4-Dihydroben...

CAS#:14944-00-4

Literature: Ohmoto, Kazuyuki; Itagaki, Iori Patent: US2003/162964 A1, 2003 ;

~%

3, 4-Dihydrobenzo[f][1, 4]thiazepin-5(2H)-one Structure

3, 4-Dihydroben...

CAS#:14944-00-4

Literature: F. HOFFMANN-LA ROCHE AG; LIANG, Chungen; WANG, Lisha; YUN, Hongying Yun; ZHENG, Xiufang Patent: WO2013/53658 A1, 2013 ;

~%

3, 4-Dihydrobenzo[f][1, 4]thiazepin-5(2H)-one Structure

3, 4-Dihydroben...

CAS#:14944-00-4

Literature: Wuensch,K.-H. et al. Zeitschrift fuer Chemie (Stuttgart, Germany), 1967 , vol. 7, p. 185 - 186

~%

3, 4-Dihydrobenzo[f][1, 4]thiazepin-5(2H)-one Structure

3, 4-Dihydroben...

CAS#:14944-00-4

Literature: Jakob,F.; Schlack,P. Chemische Berichte, 1963 , vol. 96, p. 88 - 92

~%

3, 4-Dihydrobenzo[f][1, 4]thiazepin-5(2H)-one Structure

3, 4-Dihydroben...

CAS#:14944-00-4

Literature: Grunewald, Gary L.; Dahanukar, Vilas H.; Ching, Piao; Criscione, Kevin R. Journal of Medicinal Chemistry, 1996 , vol. 39, # 18 p. 3539 - 3546

 Customs

HS Code 2934999090
Summary 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

rw2678
2,3,4,5-tetrahydro-1,4-benzothiazepin-5-one
qc-8963