Cinerin I

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Names

[ CAS No. ]:
25402-06-6

[ Name ]:
Cinerin I

[Synonym ]:
(-)-cinerin-I
(Z)-(S)-3-(but-2-enyl)-2-methyl-4-oxocyclopent-2-enyl (1R)-trans-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylate
Cinerin I
3-(but-2-enyl)-2-methyl-4-oxocyclopent-2-enyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylate
Cyclopropanecarboxylic acid,2,2-dimethyl-3-(2-methyl-1-propenyl)-,(1S)-3-(2Z)-2-butenyl-2-methyl-4-oxo-2-cyclopenten-1-yl ester,(1R,3R)
(1S)-3-(2Z)-2-buten-1-yl-2-methyl-4-oxo-2-cyclopenten-1-yl (1R,3R)-2,2-dimethyl-3-(2-methyl-1-propen-1-yl)cyclopropanecarboxylate
(Z)-(S)-3-(but-2-enyl)-2-methyl-4-oxocyclopent-2-enyl (+)-trans-chrysanthemate
(1R,3R)-2,2-DiMethyl-3-(2-Methyl-1-propenyl)cyclopropanecarboxylic Acid (1S)-3-(2Z)-2-Butenyl-2-Methyl-4-oxo-2-cyclopenten-1-yl Ester
EINECS 246-948-0
(1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropane-1-carboxylate
(Z)-(S)-3-(but-2-enyl)-2-methyl-4-oxocyclopent-2-enyl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylate

Chemical & Physical Properties

[ Density]:
1.04g/cm3

[ Boiling Point ]:
403.5ºC at 760mmHg

[ Molecular Formula ]:
C20H28O3

[ Molecular Weight ]:
316.43500

[ Flash Point ]:
173ºC

[ Exact Mass ]:
316.20400

[ PSA ]:
43.37000

[ LogP ]:
4.39210

[ Vapour Pressure ]:
1.02E-06mmHg at 25°C

[ Index of Refraction ]:
1.518

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GZ1540000
CHEMICAL NAME :
Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methylpropenyl)-, ester with 2-(2-butenyl)- 4-hydroxy-3-methyl-2-cyclopenten-1-one
CAS REGISTRY NUMBER :
25402-06-6
LAST UPDATED :
199012
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C20-H28-O3
MOLECULAR WEIGHT :
316.48
WISWESSER LINE NOTATION :
L5V BUTJ B2U2 C1 DOV- BL3TJ A1 A1 C1UY1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Unreported
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1050 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
30ZDA9 "Chemistry of Pesticides," Melnikov, N.N., New York, Springer-Verlag New York, Inc., 1971 Volume(issue)/page/year: -,131,1971

Safety Information

[ Hazard Codes ]:
Xn,N

[ Risk Phrases ]:
R22;R50/53

[ Safety Phrases ]:
S60;S61

[ RIDADR ]:
UN 2902

[ Packaging Group ]:
III

[ Hazard Class ]:
6.1(b)

Related Compounds

  • cinerin I
  • Cinerin II
  • altromycin I
  • pentactaside I
  • Eeyarestatin I
  • foliachinenoside I
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  • N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[7-(2-methoxyphenyl)-8-oxo-[1,2,4]triazolo[4,3-a]pyrazin-3-yl]sulfanyl]acetamide
  • {[7-(2-Methoxyphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]thio}acetonitrile
  • N-(3-chloro-4-methylphenyl)-2-{[7-(2-methoxyphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]thio}butanamide
  • Methyl 6-chloro-2-[(4-methoxybenzyl)amino]-3-nitrobenzoate
  • 7-(4-fluorophenyl)-3-((2-(4-(2-methoxyphenyl)piperazin-1-yl)-2-oxoethyl)thio)-[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
  • 3-((2-(4-(2-fluorophenyl)piperazin-1-yl)-2-oxoethyl)thio)-7-(4-methoxyphenyl)-[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
  • (2-Ethyl-4-hydroxyphenoxy)acetic Acid Ethyl Ester
  • 7-(4-fluorophenyl)-3-((2-(4-methoxyphenyl)-2-oxoethyl)thio)-[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
  • 3-((2-(2,4-dimethylphenyl)-2-oxoethyl)thio)-7-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
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