Carbamimidothioic acid,hexadecyl ester, monohydrobromide (9CI)

Modify Date: 2024-01-17 18:11:07

Carbamimidothioic acid,hexadecyl ester, monohydrobromide (9CI) Structure
Carbamimidothioic acid,hexadecyl ester, monohydrobromide (9CI) structure
Common Name Carbamimidothioic acid,hexadecyl ester, monohydrobromide (9CI)
CAS Number 16914-92-4 Molecular Weight 381.45800
Density N/A Boiling Point 402.6ºC at 760mmHg
Molecular Formula C17H37BrN2S Melting Point N/A
MSDS N/A Flash Point 197.3ºC

 Names

Name hexadecyl carbamimidothioate,hydrobromide
Synonym More Synonyms

 Chemical & Physical Properties

Boiling Point 402.6ºC at 760mmHg
Molecular Formula C17H37BrN2S
Molecular Weight 381.45800
Flash Point 197.3ºC
Exact Mass 380.18600
PSA 75.17000
LogP 7.85250
Vapour Pressure 1.08E-06mmHg at 25°C
Index of Refraction 1.5

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UM7875000
CHEMICAL NAME :
Pseudourea, 2-hexadecyl-2-thio-, hydrobromide
CAS REGISTRY NUMBER :
16914-92-4
LAST UPDATED :
199012
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C17-H36-N2-S.Br-H
MOLECULAR WEIGHT :
381.53
WISWESSER LINE NOTATION :
MUYZS16 &EH

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
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 :
CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 8,750,1956

 Synthetic Route

~%

Carbamimidothioic acid,hexadecyl ester, monohydrobromide (9CI) Structure

Carbamimidothio...

CAS#:16914-92-4

Literature: Yang, Zhanhui; Zheng, Yongpeng; Xu, Jiaxi Synlett, 2013 , vol. 24, # 16 art. no. ST-2013-W0601-L, p. 2165 - 2169

 Precursor & DownStream

Precursor  1

DownStream  1

 Synonyms

S-Hexadecyl-isothioharnstoff,Hydrobromid
S-Hexadecyl-isothiouronium-bromid
Pseudourea,2-hexadecyl-2-thio-,hydrobromide
WLN: MUYZS16 &Carbamimidothioic acid,hexadecyl ester,monohydrobromide
S-hexadecyl-isothiourea,hydrobromide
S-n-hexadecylisothiourea hydrobromide
S-Hexadecylisothiuronium bromide
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