(5Z)-5-(pyridin-4-ylmethylidene)-2-sulfanylidene-thiazolidin-4-one

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Names

[ CAS No. ]:
5061-42-7

[ Name ]:
(5Z)-5-(pyridin-4-ylmethylidene)-2-sulfanylidene-thiazolidin-4-one

[Synonym ]:
5-[4]pyridylmethylene-2-thioxo-thiazolidin-4-one
5-pyridin-4-ylmethylene-2-thioxo-thiazolidin-4-one
Rhodanine,5-(4-pyridylmethylene)
5-[4]Pyridylmethylen-2-thioxo-thiazolidin-4-on
5-(4-Pyridylmethylene)rhodanine

Chemical & Physical Properties

[ Density]:
1.5g/cm3

[ Molecular Formula ]:
C9H6N2OS2

[ Molecular Weight ]:
222.28700

[ Exact Mass ]:
221.99200

[ PSA ]:
99.38000

[ LogP ]:
1.89920

[ Index of Refraction ]:
1.743

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
VI8491000
CHEMICAL NAME :
Rhodanine, 5-(4-pyridylmethylene)-
CAS REGISTRY NUMBER :
5061-42-7
BEILSTEIN REFERENCE NO. :
0150503
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C9-H6-N2-O-S2
MOLECULAR WEIGHT :
222.29
WISWESSER LINE NOTATION :
T6NJ D1U- CT5MVYSYJ EUS

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#01035

Safety Information

[ HS Code ]:
2934999090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • p-Formylpyridine
  • Rhodanine

DownStream

  • [3,4,5-triacetyloxy-6-[(5Z)-4-oxo-5-(pyridin-4-ylmethylidene)-2-sulfanylidene-thiazolidin-3-yl]oxan-2-yl]methyl acetate

Customs

[ HS Code ]: 2934999090

[ Summary ]:
2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Related Compounds

  • N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-isobutyl-4-methoxy-3-methylbenzenesulfonamide
  • N-acyl-2-(diethoxyphosphoryl)glycinate
  • 5-iodo-1H-pyridazin-6-one
  • 3-Hydroxymethyl-1-(4-methylphenyl)sulfonyl-1H-indazole
  • Dimethyl-(1H-pyrrolo[3,2-c]pyridin-3-ylmethyl)-amine
  • 1,4-Oxazepan-7-one
  • Estrane-3,17-dione
  • 5-Ethoxy-2-ethyl-4-phenyl-3(2H)-pyridazinone
  • N-(1,1-dioxo-1lambda6-thiolan-3-yl)-N,2,5-trimethylbenzene-1-sulfonamide
  • N-(1,1-dioxo-1lambda6-thiolan-3-yl)-4-ethyl-N-methylbenzene-1-sulfonamide
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