β-IONOL

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Names

[ CAS No. ]:
22029-76-1

[ Name ]:
β-IONOL

[Synonym ]:
4-(2,6,6-Trimethyl-1-cyclohexenyl)-3-buten-2-ol
FEMA 3625

Chemical & Physical Properties

[ Density]:
0.928 g/mL at 20ºC(lit.)

[ Boiling Point ]:
107ºC3 mm Hg(lit.)

[ Molecular Formula ]:
C13H22O

[ Molecular Weight ]:
194.31300

[ Flash Point ]:
105.7ºC

[ Exact Mass ]:
194.16700

[ PSA ]:
20.23000

[ LogP ]:
3.45000

[ Vapour Pressure ]:
0.000431mmHg at 25°C

[ Index of Refraction ]:
n20/D 1.501

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
EM9630000
CHEMICAL NAME :
3-Buten-2-ol, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-
CAS REGISTRY NUMBER :
22029-76-1
LAST UPDATED :
199701
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C13-H22-O

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
5 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 26,361,1988
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
>5 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 26,361,1988

Safety Information

[ Hazard Codes ]:
F

[ Safety Phrases ]:
S23-S24/25

[ WGK Germany ]:
2

[ RTECS ]:
EM9630000

Synthetic Route


Related Compounds

  • 3-oxo-β-ionol
  • ethynyl-β-ionol
  • Ethinyl-β-ionol
  • Ethylene-β-ionol
  • Dihydro-3-oxo-β-ionol
  • 9-(2-propynyl)-β-ionol
  • 2-(Aminomethyl)-3-(difluoromethyl)-6-(trifluoromethyl)pyridine-4-acetic acid
  • 2-(Aminomethyl)-3-(difluoromethyl)-4-iodo-5-nitropyridine
  • 2-(4-(Trifluoromethoxy)phenyl)naphthalene
  • 2-(Aminomethyl)-3-(difluoromethyl)-5-(trifluoromethoxy)pyridine-6-sulfonamide
  • 2-(4-Bromo-3-(difluoromethyl)benzoyl)pyridine
  • 2-(Aminomethyl)-3-(difluoromethyl)-6-(trifluoromethoxy)-4-(trifluoromethyl)pyridine
  • 1-(4-Amino-3-ethoxyphenyl)-3-chloropropan-1-one
  • 1-Bromo-2-difluoromethoxy-4-fluoro-3-nitrobenzene
  • 2-Bromo-1,3-dichloro-4-nitrobenzene
  • 1,2-Dichloro-3-ethoxy-4-fluorobenzene
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