Carbamimidothioic acid,(3,6-dioxo-2,5-piperazinediyl)di-2,1-ethanediyl ester, dihydrochloride (9CI)

Modify Date: 2024-02-08 19:21:57

Carbamimidothioic acid,(3,6-dioxo-2,5-piperazinediyl)di-2,1-ethanediyl ester, dihydrochloride (9CI) Structure
Carbamimidothioic acid,(3,6-dioxo-2,5-piperazinediyl)di-2,1-ethanediyl ester, dihydrochloride (9CI) structure
Common Name Carbamimidothioic acid,(3,6-dioxo-2,5-piperazinediyl)di-2,1-ethanediyl ester, dihydrochloride (9CI)
CAS Number 6965-23-7 Molecular Weight 354.88000
Density N/A Boiling Point 706.7ºC at 760mmHg
Molecular Formula C10H19ClN6O2S2 Melting Point N/A
MSDS N/A Flash Point 381.2ºC

 Names

Name 2-[5-(2-carbamimidoylsulfanylethyl)-3,6-dioxopiperazin-2-yl]ethyl carbamimidothioate,hydrochloride

 Chemical & Physical Properties

Boiling Point 706.7ºC at 760mmHg
Molecular Formula C10H19ClN6O2S2
Molecular Weight 354.88000
Flash Point 381.2ºC
Exact Mass 354.07000
PSA 208.54000
LogP 2.06280
Index of Refraction 1.772

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TL6350000
CHEMICAL NAME :
2,5-Piperazinedione, 3,6-bis(2-amidinothioethyl)-, dihydrochloride
CAS REGISTRY NUMBER :
6965-23-7
LAST UPDATED :
199012
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C10-H18-N6-O2-S2.2Cl-H
MOLECULAR WEIGHT :
391.38
WISWESSER LINE NOTATION :
T6MV DMVTJ C2SYZUM F2SYZUM &GH 2

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 :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: AD277-689
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