α-Cetone

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Names

[ CAS No. ]:
127-51-5

[ Name ]:
α-Cetone

[Synonym ]:
ALPHA-ISO-METHYLIONONE
MFCD00034582
3-Buten-2-one, 3-methyl-4- (2,6,6-trimethyl-2-cyclohexen-1-yl)-
3-Buten-2-one, 3-methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, (3E)-
Isonaline 70
3-METHYL-ALPHA-IONONE
α-ISO-METHYLIONONE
(3E)-3-Methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-buten-2-one
a-Isomethylionone
(3E)-3-methyl-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-2-one
Cetone Alpha
α-Isomethylionone
α-Cetone
3-Methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-buten-2-one
3-Methyl-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-2-one
EINECS 204-846-3

Chemical & Physical Properties

[ Density]:
0.9±0.1 g/cm3

[ Boiling Point ]:
285.3±29.0 °C at 760 mmHg

[ Molecular Formula ]:
C14H22O

[ Molecular Weight ]:
206.324

[ Flash Point ]:
122.1±17.5 °C

[ Exact Mass ]:
206.167068

[ PSA ]:
17.07000

[ LogP ]:
4.41

[ Vapour Pressure ]:
0.0±0.6 mmHg at 25°C

[ Index of Refraction ]:
1.508

[ Storage condition ]:
room temp

MSDS

Click to get detail MSDS

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H317-H412

[ Precautionary Statements ]:
P273-P280-P333 + P313

[ Hazard Codes ]:
Xi

[ Risk Phrases ]:
43

[ Safety Phrases ]:
S24/25

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
2

[ HS Code ]:
2914299000

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 3,6,10-trimethyl-undeca-3,5,10-trien-2-one
  • 3,7-Dimethyl-7-octen-1-yn-3-ol

DownStream

Customs

[ HS Code ]: 2914299000

[ Summary ]:
2914299000. other cyclanic, cyclenic or cyclotherpenic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%

Related Compounds

  • α-(3,4-Dimethoxyphenyl)-4-[(3,4-dimethoxyphenyl)methyl]tetrahydro-3-hydroxyfuran-3-methanol
  • α-deutero benzylamine
  • α-((N-(2-aminobenzyl)-N-methylamino)methyl)-3,4-dimethoxybenzyl alcohol
  • α-(((2-nitrobenzylidene)amino)methyl)-3,4-dimethoxybenzyl alcohol
  • α-benzylserine methyl ester
  • α-Amino-2-carboxy-1-azetidinebutanoic acid
  • 2-(1-benzyl-3,5-dimethyl-1H-pyrazol-4-yl)prop-2-en-1-amine
  • (2S)-1-(1-benzylpyrrolidin-2-yl)propan-2-ol
  • tert-butyl N-[1-(3,6-dichloropyridazin-4-yl)-2-oxoethyl]carbamate
  • 1-(difluoromethyl)-N-methyl-1H-1,3-benzodiazol-2-amine
  • 2-Amino-3-(3-methylpyrazin-2-yl)propan-1-ol
  • 1-{3-[(Dimethylamino)methyl]-4-methoxyphenyl}cyclopropane-1-carbaldehyde
  • 1-Ethyl-4-(2-isocyanatopropan-2-yl)cyclohexane
  • 2-Bromo-1-(2,4-dimethoxypyridin-3-yl)ethan-1-ol
  • 2-[3-(piperidin-3-yl)propyl]-1H-1,3-benzodiazole
  • 1-[4-(2-isocyanatoethyl)phenyl]-1H-pyrazole
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