Acetamidine, N-((3,5-dimethyl)-1-adamantyl)methyl-2-mercapto-, HCl

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Names

[ CAS No. ]:
40284-11-5

[ Name ]:
Acetamidine, N-((3,5-dimethyl)-1-adamantyl)methyl-2-mercapto-, HCl

Chemical & Physical Properties

[ Density]:
1.25g/cm3

[ Boiling Point ]:
369.4ºC at 760 mmHg

[ Molecular Formula ]:
C15H27ClN2S

[ Molecular Weight ]:
302.90600

[ Flash Point ]:
177.2ºC

[ Exact Mass ]:
302.15800

[ PSA ]:
74.68000

[ LogP ]:
4.77230

[ Index of Refraction ]:
1.648

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AD0690000
CHEMICAL NAME :
Acetamidine, N-((3,5-dimethyl)-1-adamantyl)methyl-2-mercapto-, hydrochloride
CAS REGISTRY NUMBER :
40284-11-5
LAST UPDATED :
199012
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C15-H26-N2-S.Cl-H
MOLECULAR WEIGHT :
302.95
WISWESSER LINE NOTATION :
L66 B6/B-H/DI A B- C 1B ITJ B1MYUM&1SH D1 F1 &GH

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 :
175 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 15,1313,1972
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
10 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 15,1313,1972

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
  • benzyl N-[3-(3-chloro-4-methoxybenzoyl)-4H,5H,6H-cyclopenta[b]thiophen-2-yl]carbamate
  • 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
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • tert-Butyl-DL-alanine
  • 4-amino-N-[2-tert-butyl-1-(tetrahydro-2H-pyran-4-ylmethyl)-1H-benzimidazol-5-yl]-N-ethylbenzenesulfonamide