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CAS Number: 58980-39-5
2,3,4,5-tetrahydrobenzo[f][1,4]thiazepine

Structure

2,3,4,5-tetrahydrobenzo[f][1,4]thiazepine
Name: 2,3,4,5-tetrahydrobenzo[f][1,4]thiazepine
Synonyms:
General Information
Product Number: 58980395

CAS Registry Number 58980-39-5
Name:
1,​4-​Benzothiazepine, 2,​3,​4,​5-​tetrahydro-
2,3,4,5-Tetrahydro-1,4-benzothiazepine

 

Chemical Formula: C9H11NS
Exact Mass: 165.06
Molecular Weight: 165.26
m/z: 165.06 (100.0%), 166.06 (10.9%), 167.06 (4.6%)

 

InChI:InChI=1S/C9H11NS/c1-2-4-9-8(3-1)7-10-5-6-11-9/h1-4,10H,5-7H2

InChI Key:SUBDEKBXSIKCSA-UHFFFAOYSA-N

Canonical SMILES:C1CSC2=CC=CC=C2CN1

 

Thermal Properties Value Condition Note
Boiling Point 88 °C Press: 0.35 Torr (1)IC

Specification

98%

References
  1. (1) Boudet, Roger; Comptes Rendus des Seances de l'Academie des Sciences, Serie C: Sciences Chimiques 1976, V282(4), P249-51 CAPLUS
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