Carbamimidothioic acid,(2,6-dimethylphenyl)-, methyl ester, monohydriodide (9CI)

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Names

[ CAS No. ]:
27806-86-6

[ Name ]:
Carbamimidothioic acid,(2,6-dimethylphenyl)-, methyl ester, monohydriodide (9CI)

Chemical & Physical Properties

[ Boiling Point ]:
348.8ºC at 760mmHg

[ Molecular Formula ]:
C10H15IN2S

[ Molecular Weight ]:
322.20900

[ Flash Point ]:
164.8ºC

[ Exact Mass ]:
322.00000

[ PSA ]:
61.18000

[ LogP ]:
4.18400

[ Vapour Pressure ]:
4.9E-05mmHg at 25°C

[ Index of Refraction ]:
1.567

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UM9275800
CHEMICAL NAME :
Pseudourea, 2-methyl-2-thio-3-(2,6-xylyl)-, hydriodide
CAS REGISTRY NUMBER :
27806-86-6
LAST UPDATED :
198609
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C10-H14-N2-S.H-I
MOLECULAR WEIGHT :
322.23
WISWESSER LINE NOTATION :
MUYS1&MR B1 F1 &IH

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
56 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#08544

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Thiourea,N-(2,6-dimethylphenyl)-
  • methyl iodide

DownStream

Related Compounds

  • N-[2-(6-Methoxy-1H-benzimidazol-2-yl)ethyl]-N-methylbut-2-ynamide
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • 5-[4-(2-Pyridinyloxy)phenyl]-1H-pyrazol-3-amine
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • N-[(1-Pyrimidin-2-ylpiperidin-3-yl)methyl]but-2-ynamide