4-Phenylimidazole-2-thiol

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Names

[ CAS No. ]:
6857-34-7

[ Name ]:
4-Phenylimidazole-2-thiol

[Synonym ]:
4-phenyl-1,3-dihydroimidazole-2-thione

Chemical & Physical Properties

[ Density]:
1.3g/cm3

[ Boiling Point ]:
302.3ºC at 760 mmHg

[ Molecular Formula ]:
C9H8N2S

[ Molecular Weight ]:
176.23800

[ Flash Point ]:
136.6ºC

[ Exact Mass ]:
176.04100

[ PSA ]:
67.48000

[ LogP ]:
2.36540

[ Index of Refraction ]:
1.711

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NI8628000
CHEMICAL NAME :
Imidazole-2-thiol, 4-phenyl-
CAS REGISTRY NUMBER :
6857-34-7
LAST UPDATED :
198806
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C9-H8-N2-S
MOLECULAR WEIGHT :
176.25
WISWESSER LINE NOTATION :
T5N CNJ BSH DR

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CPBTAL Chemical and Pharmaceutical Bulletin. (Japan Pub. Trading Co., USA, 1255 Howard St., San Francisco, CA 94103) V.6- 1958- Volume(issue)/page/year: 32,2536,1984

Safety Information

[ Symbol ]:

GHS05, GHS07

[ Signal Word ]:
Danger

[ Hazard Statements ]:
H302-H318

[ Precautionary Statements ]:
P280-P305 + P351 + P338

[ RIDADR ]:
NONH for all modes of transport

[ HS Code ]:
2933290090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Potassium thiocyanate
  • 2-Amino-1-phenylethanone hydrochloride
  • ethyl 2-amino-2-phenylacetate
  • phenacyl-thiourea
  • Trinitrophenol
  • 2-Amino-1-phenylethanone

DownStream

  • Imidazo[2,1-b]thiazole,3-methyl-6-phenyl-
  • 2-methylsulfanyl-5-phenyl-1H-imidazole
  • 1-BENZOYL-4-PHENYLIMIDAZOLE
  • 4-PHENYLIMIDAZOLE
  • Imidazo[2,1-b]thiazole,6-phenyl-
  • 2-benzylsulfanyl-4-phenyl-3H-imidazole

Customs

[ HS Code ]: 2933290090

[ Summary ]:
2933290090. other compounds containing an unfused imidazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Related Compounds

  • 1,5-dimethyl-4-phenylimidazole,2,4,6-trinitrophenol
  • 1-hydroxy-2,2,5,5-tetramethyl-4-phenylimidazole
  • 1H-Imidazole-1,2-diamine,4-phenyl-N1-(phenylmethylene)-
  • 4-triethoxysilylbutane-2-thiol
  • 4-Methyl-2-thio-1,3-thiazole
  • 4-BROMOBENZOTHIAZOLE-2-THIOL
  • tert-Butyl 3-((methyl(5-nitrobenzo[d]thiazol-2-yl)amino)methyl)pyrrolidine-1-carboxylate
  • tert-Butyl 3-((methyl(6-nitroquinoxalin-2-yl)amino)methyl)pyrrolidine-1-carboxylate
  • tert-Butyl 3-((methyl(quinoxalin-2-yl)amino)methyl)pyrrolidine-1-carboxylate
  • tert-Butyl 3-(((3-chloroquinoxalin-2-yl)(methyl)amino)methyl)pyrrolidine-1-carboxylate
  • tert-Butyl 3-(((1H-benzo[d]imidazol-2-yl)(methyl)amino)methyl)pyrrolidine-1-carboxylate
  • tert-Butyl 3-((benzo[d]oxazol-2-yl(methyl)amino)methyl)pyrrolidine-1-carboxylate
  • tert-Butyl 3-((benzo[d]thiazol-2-yl(methyl)amino)methyl)pyrrolidine-1-carboxylate
  • tert-Butyl 3-(((3H-imidazo[4,5-b]pyridin-2-yl)(methyl)amino)methyl)pyrrolidine-1-carboxylate
  • tert-Butyl 3-((benzo[d]isothiazol-3-yl(methyl)amino)methyl)pyrrolidine-1-carboxylate
  • tert-Butyl 3-((methyl(2-oxo-2-(1H-pyrrol-2-yl)ethyl)amino)methyl)pyrrolidine-1-carboxylate
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