30771-86-9

30771-86-9 structure
30771-86-9 structure

Name 1-[1-[(1-amino-2-sulfosulfanylethylidene)amino]propan-2-yloxy]adamantane
Synonyms S-((N-(2-(1-Adamantyloxy)-2-methylethyl)amidino)methyl) hydrogen thiosulfate
Thiosulfuric acid,S-ester with N-(2-(1-adamantyloxy)propyl)-2-mercaptoacetamidine
Methanethiol,N-(2-(1-adamantyloxy)-2-methylethyl)amidino-,hydrogen thiosulfate (ester)
Density 1.55g/cm3
Molecular Formula C15H26N2O4S2
Molecular Weight 362.50800
Exact Mass 362.13300
PSA 133.16000
LogP 4.03460
Index of Refraction 1.69

CHEMICAL IDENTIFICATION

RTECS NUMBER :
PB4551000
CHEMICAL NAME :
Methanethiol, N-(2-(1-adamantyloxy)-2-methylethyl)amidino-, hydrogen thiosulfate (ester)
CAS REGISTRY NUMBER :
30771-86-9
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C15-H26-N2-O4-S2
MOLECULAR WEIGHT :
362.55
WISWESSER LINE NOTATION :
L66 B6/B-H/DI A B- C 1B ITJ BO1Y1&MYUM&1SSWQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
60 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
HS Code 2930909090
HS Code 2930909090
Summary 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%