N,N-dimethyl-2-(5-methylsulfanyl-1H-indol-3-yl)ethanamine

Names

[ CAS No. ]:
5102-11-4

[ Name ]:
N,N-dimethyl-2-(5-methylsulfanyl-1H-indol-3-yl)ethanamine

[Synonym ]:
3-<Dimethylamino-ethyl>-5-methylmercapto-indol
N,N-Dimethyl-5-methylthiotryptamine
5-Methylthiodimethyltryptamine

Chemical & Physical Properties

[ Density]:
1.13g/cm3

[ Boiling Point ]:
400.3ºC at 760 mmHg

[ Molecular Formula ]:
C13H18N2S

[ Molecular Weight ]:
234.36000

[ Flash Point ]:
195.9ºC

[ Exact Mass ]:
234.11900

[ PSA ]:
44.33000

[ LogP ]:
2.99390

[ Index of Refraction ]:
1.629

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NL7445000
CHEMICAL NAME :
Indole, 3-(2-(dimethylamino)ethyl)-5-methylthio-
CAS REGISTRY NUMBER :
5102-11-4
BEILSTEIN REFERENCE NO. :
0395065
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H18-N2-S
MOLECULAR WEIGHT :
234.39
WISWESSER LINE NOTATION :
T56 BMJ D2N1&1 GS1

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 :
50 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#12318

Safety Information

[ HS Code ]:
2933990090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Formaldehyde
  • 2-(5-methylthioindol-3-yl)ethylamine

DownStream

Customs

[ HS Code ]: 2933990090

[ Summary ]:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Related Compounds

  • Tert-butyl 4-aminobicyclo[2.1.1]hexane-1-carboxylate
  • 2-{[(benzyloxy)carbonyl][(1-methyl-1H-pyrazol-4-yl)methyl]amino}acetic acid
  • 5-Acetyl-2-{[(benzyloxy)carbonyl]amino}-1,3-thiazole-4-carboxylic acid
  • 2-{[(Benzyloxy)carbonyl]amino}-5-(propan-2-yloxy)benzoic acid
  • 2-({1-[(Benzyloxy)carbonyl]piperidin-4-yl}methyl)benzoic acid
  • 1-[(Benzyloxy)carbonyl]-5-[(4-hydroxyphenyl)methyl]pyrrolidine-2-carboxylic acid
  • Tert-butyl 7,7-difluoro-2-azabicyclo[4.1.0]heptane-5-carboxylate
  • 2-[(1R,2S,4R)-2-{[(benzyloxy)carbonyl]amino}-4-(tert-butoxy)cyclobutyl]acetic acid
  • 2-{[(Tert-butoxy)carbonyl]amino}-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid
  • 4-{1-[(Benzyloxy)carbonyl]pyrrolidin-2-yl}-4-oxobutanoic acid
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