N-carbamothioyloctanamide

Modify Date: 2025-08-25 22:07:17

N-carbamothioyloctanamide Structure
N-carbamothioyloctanamide structure
Common Name N-carbamothioyloctanamide
CAS Number 42113-92-8 Molecular Weight 202.31700
Density 1.055g/cm3 Boiling Point N/A
Molecular Formula C9H18N2OS Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name N-carbamothioyloctanamide
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.055g/cm3
Molecular Formula C9H18N2OS
Molecular Weight 202.31700
Exact Mass 202.11400
PSA 95.24000
LogP 3.26770
Index of Refraction 1.519
InChIKey DXZVIWFRNGADRH-UHFFFAOYSA-N
SMILES CCCCCCCC(=O)NC(N)=S

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
YT9800000
CHEMICAL NAME :
Urea, 1-octanoyl-2-thio-
CAS REGISTRY NUMBER :
42113-92-8
BEILSTEIN REFERENCE NO. :
1773550
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C9-H18-N2-O-S
MOLECULAR WEIGHT :
202.35
WISWESSER LINE NOTATION :
SUYZMV7

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>5 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JACSAT Journal of the American Chemical Society. (American Chemical Soc., Distribution Office Dept. 223, POB 57136, West End Stn., Washington, DC 20037) V.1- 1879- Volume(issue)/page/year: 62,3273,1940
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
500 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

 Safety Information

HS Code 2930909090

 Customs

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%

 Synonyms

USAF B-105
Urea,1-octanoyl-2-thio
1-OCTANOYL-2-THIOUREA
Octanoyl thiourea
Capryloylthioharnstoff
Octanoyl-thioharnstoff
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