40283-72-5

40283-72-5 structure
40283-72-5 structure

Name 1-[[(1-amino-2-sulfosulfanylethylidene)amino]methyl]adamantane
Synonyms Methanethiol,(N-1-adamantylmethyl)amidino-,hydrogen sulfate (ester)
S-(2-((1-Adamantylmethyl)amino)-2-iminoethyl) hydrogen thiosulfate
S-((N-1-Adamantylmethylamidino)methyl) hydrogen thiosulfate
S-<N1-(Adamantyl-(1)-methyl)-amidino-methyl>-thiosulfat
Density 1.63g/cm3
Molecular Formula C13H22N2O3S2
Molecular Weight 318.45500
Exact Mass 318.10700
PSA 123.93000
LogP 3.87710
Index of Refraction 1.739

CHEMICAL IDENTIFICATION

RTECS NUMBER :
PB4530000
CHEMICAL NAME :
Methanethiol, (N-1-adamantylmethyl)amidino-, hydrogen sulfate (ester)
CAS REGISTRY NUMBER :
40283-72-5
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H22-N2-O3-S2
MOLECULAR WEIGHT :
318.49
WISWESSER LINE NOTATION :
L66 B6/B-H/DI A B- C 1B ITJ B1MYUM&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 :
25 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%