6-methylsulfanyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole

Modify Date: 2025-12-18 20:30:55

6-methylsulfanyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole Structure
6-methylsulfanyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole structure
 Common Name 6-methylsulfanyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
CAS Number 13758-34-4 Molecular Weight 218.31800
Density 1.27g/cm3 Boiling Point 420ºC at 760 mmHg
Molecular Formula C12H14N2S Melting Point N/A
MSDS N/A Flash Point 207.8ºC

 Names

Name 6-methylsulfanyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole

 Chemical & Physical Properties

Density 1.27g/cm3
Boiling Point 420ºC at 760 mmHg
Molecular Formula C12H14N2S
Molecular Weight 218.31800
Flash Point 207.8ºC
Exact Mass 218.08800
PSA 53.12000
LogP 2.86430
Vapour Pressure 2.91E-07mmHg at 25°C
Index of Refraction 1.701
InChIKey CDKWKTNSSJEIBH-UHFFFAOYSA-N
SMILES CSc1ccc2[nH]c3c(c2c1)CCNC3

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UV0900000
CHEMICAL NAME :
9H-Pyrido(3,4-b)indole, 1,2,3,4-tetrahydro-6-methylthio-
CAS REGISTRY NUMBER :
13758-34-4
BEILSTEIN REFERENCE NO. :
0647144
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H14-N2-S

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
89 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#12511
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Chemsrc provides CAS#:13758-34-4 MSDS, density, melting point, boiling point, structure, etc. Its name is 6-methylsulfanyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole>> amp version: 6-methylsulfanyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole

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