3-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]propan-1-ol,methanesulfonic acid

Modify Date: 2025-11-25 18:59:05

3-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]propan-1-ol,methanesulfonic acid Structure
3-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]propan-1-ol,methanesulfonic acid structure
 Common Name 3-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]propan-1-ol,methanesulfonic acid
CAS Number 34775-65-0 Molecular Weight 581.16500
Density N/A Boiling Point N/A
Molecular Formula C23H33ClN2O7S3 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 3-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]propan-1-ol,methanesulfonic acid
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C23H33ClN2O7S3
Molecular Weight 581.16500
Exact Mass 580.11400
PSA 177.51000
LogP 5.13380
InChIKey UKNSILPDRRFKCO-UHFFFAOYSA-N
SMILES CS(=O)(=O)O.CS(=O)(=O)O.OCCCN1CCN(C2Cc3ccccc3Sc3ccc(Cl)cc32)CC1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TM2663060
CHEMICAL NAME :
1-Piperazinepropanol, 4-(8-chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-, dimethanesulfonate
CAS REGISTRY NUMBER :
34775-65-0
LAST UPDATED :
198703
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C21-H25-Cl-N2-O-S.2C-H4-O3-S
MOLECULAR WEIGHT :
581.21

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
202 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CCCCAK Collection of Czechoslovak Chemical Communications. (Academic Press Inc. Ltd., 24-28 Oval Rd., London NW1 7DX, UK) V.1- 1929- Volume(issue)/page/year: 41,443,1976
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
73200 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CCCCAK Collection of Czechoslovak Chemical Communications. (Academic Press Inc. Ltd., 24-28 Oval Rd., London NW1 7DX, UK) V.1- 1929- Volume(issue)/page/year: 41,443,1976

 Synonyms

Oxyclothepin dimethanesulfonate
VUFB8,387
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Chemsrc provides CAS#:34775-65-0 MSDS, density, melting point, boiling point, structure, etc. Its name is 3-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]propan-1-ol,methanesulfonic acid>> amp version: 3-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]propan-1-ol,methanesulfonic acid

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