3-Amino-2,3-dihydro-1,5-benzothiazepin-4(5H)-one

Modify Date: 2025-08-23 11:00:30

3-Amino-2,3-dihydro-1,5-benzothiazepin-4(5H)-one Structure
3-Amino-2,3-dihydro-1,5-benzothiazepin-4(5H)-one structure
Common Name 3-Amino-2,3-dihydro-1,5-benzothiazepin-4(5H)-one
CAS Number 96346-81-5 Molecular Weight 194.253
Density 1.3±0.1 g/cm3 Boiling Point 403.1±45.0 °C at 760 mmHg
Molecular Formula C9H10N2OS Melting Point N/A
MSDS N/A Flash Point 197.6±28.7 °C

 Names

Name 3-amino-2,3-dihydro-1,5-benzothiazepin-4(5h)-one
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.3±0.1 g/cm3
Boiling Point 403.1±45.0 °C at 760 mmHg
Molecular Formula C9H10N2OS
Molecular Weight 194.253
Flash Point 197.6±28.7 °C
Exact Mass 194.051376
PSA 80.42000
LogP 0.46
Vapour Pressure 0.0±0.9 mmHg at 25°C
Index of Refraction 1.615
InChIKey CVTKHBONQJBXKR-UHFFFAOYSA-N
SMILES NC1CSc2ccccc2NC1=O
Storage condition 2-8℃

 Safety Information

HS Code 2934999090

 Synthetic Route

~69%

3-Amino-2,3-dihydro-1,5-benzothiazepin-4(5H)-one Structure

3-Amino-2,3-dih...

CAS#:96346-81-5

Literature: Pfizer, Inc. Patent: US5618808 A1, 1997 ; US 5618808 A

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3-Amino-2,3-dihydro-1,5-benzothiazepin-4(5H)-one Structure

3-Amino-2,3-dih...

CAS#:96346-81-5

Literature: Morton, George C.; Salvino, Joseph M.; Labaudiniere, Richard F.; Herpin, Timothy F. Tetrahedron Letters, 2000 , vol. 41, # 17 p. 3029 - 3033

 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

3-Amino-2,3-dihydro-1,5-benzothiazepin-4(5H)-one HCl
3-Amino-2,3-dihydro-1,5-benzothiazepin-4(5H)-one
3-amino-2,3-dihydro-5H-1,5-benzothiazepin-4-one
(R,S)-3-Amino-2,3-dihydro-1,5-benzothiazepin-4(5H)-one
3(S)-amino-2,3,4,5-tetrahydro-1,5-benzothiazepin-4(5H)-one
3(R)-amino-2,3-dihydro-1,5(5H)-benzothiazepin-4-one
1,5-Benzothiazepin-4(5H)-one, 3-amino-2,3-dihydro-
3(S)-amino-3,4-dihydro-1,5-benzothiazepin-4(5H)-one
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