Pseudourea, 2-hexadecyl-1,3-dimethyl-2-thio-, monohydriodide

Modify Date: 2025-10-01 16:40:21

Pseudourea, 2-hexadecyl-1,3-dimethyl-2-thio-, monohydriodide Structure
Pseudourea, 2-hexadecyl-1,3-dimethyl-2-thio-, monohydriodide structure
Common Name Pseudourea, 2-hexadecyl-1,3-dimethyl-2-thio-, monohydriodide
CAS Number 5339-45-7 Molecular Weight 456.51200
Density 0.91g/cm3 Boiling Point 420.6ºC at 760 mmHg
Molecular Formula C19H41IN2S Melting Point N/A
MSDS N/A Flash Point 208.2ºC

 Names

Name hexadecyl N,N'-dimethylcarbamimidothioate,hydroiodide
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.91g/cm3
Boiling Point 420.6ºC at 760 mmHg
Molecular Formula C19H41IN2S
Molecular Weight 456.51200
Flash Point 208.2ºC
Exact Mass 456.20400
PSA 49.69000
LogP 7.79520
Index of Refraction 1.486
InChIKey IOLFLTFZPJRMLY-UHFFFAOYSA-N
SMILES CCCCCCCCCCCCCCCCSC(=NC)NC.I

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UM7175000
CHEMICAL NAME :
Pseudourea, 2-hexadecyl-1,3-dimethyl-2-thio-, hydriodide
CAS REGISTRY NUMBER :
5339-45-7
LAST UPDATED :
199712
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C19-H40-N2-S.H-I
MOLECULAR WEIGHT :
456.58
WISWESSER LINE NOTATION :
16SYM1&UN &HI

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
125 mg/kg
TOXIC EFFECTS :
Behavioral - altered sleep time (including change in righting reflex)
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

 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

hexadecyl n,n'-dimethylcarbamimidothioate hydroiodide(1:1)
2-Hexadecyl-1,3-dimethyl-2-thiopseudourea hydriodide
WLN: 16SYM1&UN &HI
Pseudourea,2-hexadecyl-1,3-dimethyl-2-thio-,hydriodide
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