3-(o-Tolylthio)-1,2-propanediol

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Names

[ CAS No. ]:
63991-88-8

[ Name ]:
3-(o-Tolylthio)-1,2-propanediol

[Synonym ]:
3-o-Tolylmercapto-propan-1,2-diol
3-o-tolylsulfanyl-propane-1,2-diol

Chemical & Physical Properties

[ Density]:
1.2g/cm3

[ Boiling Point ]:
366.9ºC at 760mmHg

[ Molecular Formula ]:
C10H14O2S

[ Molecular Weight ]:
198.28200

[ Flash Point ]:
178.4ºC

[ Exact Mass ]:
198.07100

[ PSA ]:
65.76000

[ LogP ]:
1.44030

[ Index of Refraction ]:
1.597

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TZ1470000
CHEMICAL NAME :
1,2-Propanediol, 3-(o-tolylthio)-
CAS REGISTRY NUMBER :
63991-88-8
BEILSTEIN REFERENCE NO. :
3251796
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C10-H14-O2-S
MOLECULAR WEIGHT :
198.30
WISWESSER LINE NOTATION :
Q1YQ1SR B1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
600 mg/kg
TOXIC EFFECTS :
Peripheral Nerve and Sensation - flaccid paralysis without anesthesia (usually neuromuscular blockage) Behavioral - muscle weakness Lungs, Thorax, or Respiration - other changes
REFERENCE :
JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 93,470,1948

Synthetic Route

Click to get detail synthetic route

Related Compounds

  • 3-(o-Ethoxybenzyloxy)-1,2-propanediol
  • 3-(o-Formylphenoxy)-1,2-propanediol
  • 3-(o-Butoxyphenoxy)-1,2-propanediol
  • 3-(o-Butyrylphenoxy)-1,2-propanediol
  • 3-(o-Propylphenoxy)-1,2-propanediol
  • 3-(o-Ethylphenoxy)-1,2-propanediol
  • 4-([1,1'-Biphenyl]-4-yloxy)butan-1-amine
  • Morpholin-4-yl{5-[4-(propan-2-yl)phenyl]furan-2-yl}methanethione
  • (Z)-2-((6-bromo-4H-benzo[d][1,3]dioxin-8-yl)methylene)-6-(2-oxopropoxy)benzofuran-3(2H)-one
  • Methyl 8,12,12-trimethyl-3-[(2-piperidin-1-ylacetyl)amino]-11-oxa-5-thia-7-azatricyclo[7.4.0.02,6]trideca-1,3,6,8-tetraene-4-carboxylate
  • Ethyl 6-(2-methoxyphenyl)-4-oxo-2-(4-phenylpiperazin-1-yl)-1,4,5,6-tetrahydropyrimidine-5-carboxylate
  • 2-Hydrazinyl-6-methoxyquinoline
  • (2E)-2-[(1-ethyl-1H-indol-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 3,5-dimethoxybenzoate
  • 2-Propenoic acid, 3-[10-[2-(dimethylamino)propyl]-10H-phenothiazin-2-yl]-, (E)-
  • 2-(2,6-dimethylphenoxy)-N-[2-(furan-2-yl)-2-(pyrrolidin-1-yl)ethyl]acetamide
  • 4-Tert-butyl-2-[(4-tert-butyl-1,3-oxazol-2-yl)disulfanyl]-1,3-oxazole
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