3-AMINO-1,4-DIMETHYL-5H-PYRIDO[4,3-B]INDOLE, ACETATE

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Names

[ CAS No. ]:
68808-54-8

[ Name ]:
3-AMINO-1,4-DIMETHYL-5H-PYRIDO[4,3-B]INDOLE, ACETATE

[Synonym ]:
3-amino-1,4-dimethyl-5h-pyrido[4,3-b]indole, acetate

Chemical & Physical Properties

[ Boiling Point ]:
460.2ºC at 760 mmHg

[ Melting Point ]:
250-260ºC

[ Molecular Formula ]:
C15H17N3O2

[ Molecular Weight ]:
271.31400

[ Flash Point ]:
263ºC

[ Exact Mass ]:
271.13200

[ PSA ]:
92.00000

[ LogP ]:
3.58720

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UU9352000
CHEMICAL NAME :
5H-Pyrido(4,3-b)indole, 3-amino-1,4-dimethyl-, acetate
CAS REGISTRY NUMBER :
68808-54-8
LAST UPDATED :
199806
DATA ITEMS CITED :
12
MOLECULAR FORMULA :
C13-H13-N3.C2-H4-O2
MOLECULAR WEIGHT :
271.35

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1539 mg/kg/29W-C
TOXIC EFFECTS :
Tumorigenic - Carcinogenic by RTECS criteria Liver - tumors
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
11 gm/kg/89W-C
TOXIC EFFECTS :
Tumorigenic - Carcinogenic by RTECS criteria Lungs, Thorax, or Respiration - tumors Liver - tumors
TYPE OF TEST :
Specific locus test
TYPE OF TEST :
DNA adduct
TYPE OF TEST :
Cytogenetic analysis
TYPE OF TEST :
Sister chromatid exchange
TYPE OF TEST :
Micronucleus test
TYPE OF TEST :
Micronucleus test

MUTATION DATA

TEST SYSTEM :
Rodent - mouse
DOSE/DURATION :
25 mg/kg
REFERENCE :
MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 395,57,1997

Safety Information

[ Hazard Codes ]:
Xi

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • ethyl 2-(cyanomethyl)indole-1-carboxylate
  • 1(2H)-Quinolinecarboxylicacid, 2-cyano-, ethyl ester
  • 2-(1-cyanoethyl)-N-ethoxycarbonylindole
  • 5-[[2-[1-(benzenesulfonyl)indolyl]]ethylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
  • 3-(2-indolyl)-2-butenoic acid
  • methyl 3-(2-indolyl)-2-butenoate

DownStream

Related Compounds

  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4-amino-N-(butan-2-yl)-N-methyl-N-propylbenzene-1-sulfonoimidamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • tert-Butyl-DL-alanine
  • 4-Cyclopropyl-1-(ethylamino)hexane-2,4-diol