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
  • N-(butan-2-yl)-6-(ethoxymethyl)pyrimidin-4-amine
  • 4-[4-(Trifluoromethoxy)phenyl]-1,4-diazepan-5-one hydrochloride
  • 3-[(1-hydroxycyclohexyl)methylamino]phenol
  • 6-(cyclopropylmethyl)-N-propylpyrimidin-4-amine
  • 3-{[6-(2-Methylbutan-2-yl)pyrimidin-4-yl]amino}propan-1-ol
  • 1-[6-(2-Methylbutan-2-yl)pyrimidin-4-yl]azetidine-3-carboxylic acid
  • 2-Fluoro-2,3,3-trimethylbutane-1-sulfonyl chloride
  • 2-{[6-(Cyclopent-3-en-1-yl)pyrimidin-4-yl](2-hydroxyethyl)amino}ethan-1-ol
  • 6-(cyclopent-3-en-1-yl)-N-(piperidin-4-yl)pyrimidin-4-amine
  • 2-[(Piperidin-4-yl)methyl]-2,3,5,6,7,8-hexahydrocinnolin-3-one
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