sodium,7-oxocyclohepta-1,3,5-trien-1-olate

Names

[ CAS No. ]:
42887-08-1

[ Name ]:
sodium,7-oxocyclohepta-1,3,5-trien-1-olate

[Synonym ]:
Na-Troponolonat
2-Hydroxy-2,4,6-cycloheptatrien-1-one sodium salt
Sodium tropolonate
Natrium-tropolonat
2,4,6-Cycloheptatrien-1-one,2-hydroxy-,sodium salt
sodium troponolate
Tropolone,sodium deriv.
Sodium salt of tropolone
tropolone,sodium-salt

Chemical & Physical Properties

[ Boiling Point ]:
290.1ºC at 760 mmHg

[ Molecular Formula ]:
C7H5NaO2

[ Molecular Weight ]:
144.10300

[ Flash Point ]:
122ºC

[ Exact Mass ]:
144.01900

[ PSA ]:
40.13000

[ LogP ]:
1.19060

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GU4602000
CHEMICAL NAME :
2,4,6-Cycloheptatrien-1-one, 2-hydroxy-, sodium salt
CAS REGISTRY NUMBER :
42887-08-1
LAST UPDATED :
199303
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C7-H5-O2.Na
MOLECULAR WEIGHT :
144.11

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
385 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
GWXXBX German Offenlegungsschrift Patent Document. (U.S. Patent and Trademark Office, Foreign Patents, Washington, DC 20231) Volume(issue)/page/year: #3149608

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Tropolone

DownStream

  • 2-(2,4,6-trinitrophenoxy)cyclohepta-2,4,6-trien-1-one

Related Compounds

  • indium-111(3+),7-oxocyclohepta-1,3,5-trien-1-olate
  • indium tris(tropolonate)
  • 2-[(7-oxocyclohepta-1,3,5-trien-1-yl)azaniumyl]ethyl-di(propan-2-yl)azanium,dichloride
  • N-(7-oxocyclohepta-1,3,5-trien-1-yl)-2-piperidin-1-ylacetamide,hydrochloride
  • N-(7-oxocyclohepta-1,3,5-trien-1-yl)-2-pyrrolidin-1-ylacetamide,hydrochloride
  • SODIUM HINOKITIOL
  • (E)-1-(3-((3-chlorophenyl)amino)-2-cyano-3-oxoprop-1-en-1-yl)piperidine-4-carboxamide
  • (Z)-N-(4-((2-((4-chlorophenyl)sulfonyl)-2-cyanovinyl)amino)phenyl)acetamide
  • (2Z)-2-[(4-chlorophenyl)sulfonyl]-3-{[4-(diethylamino)phenyl]amino}prop-2-enenitrile
  • (Z)-3-(2,3-dimethoxybenzylidene)-2,3-dihydropyrrolo[1,2-a]quinazolin-5(1H)-one
  • (Z)-7,8-dimethoxy-3-(4-methylbenzylidene)-2,3-dihydropyrrolo[1,2-a]quinazolin-5(1H)-one
  • (Z)-N-(1-(1-cyano-2-(hexylamino)-2-oxoethylidene)-1H-isoindol-3-yl)-4-methoxybenzamide
  • (Z)-N-(1-(1-cyano-2-(hexylamino)-2-oxoethylidene)-1H-isoindol-3-yl)-4-nitrobenzamide
  • (2E)-2-{[(3,5-dimethoxyphenyl)amino]methylidene}-3-methyl-1-oxo-1,2-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile
  • 1-(1-carboxyethyl)-4,5-diphenyl-1H-imidazole 3-oxide
  • 4-amino-N-cyclohexylpyrimido[1,2-a]benzimidazole-3-carboxamide
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