3-Methyl-2-cyclohexen-1-one
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3-Methyl-2-cyclohexen-1-one
structure -
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CAS No:
1193-18-6
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Formula:
C7H10O
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Chemical Name:
3-Methyl-2-cyclohexen-1-one
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Synonyms:
2-Cyclohexen-1-one,3-methyl-;3-Methyl-2-cyclohexen-1-one;1-Methyl-1-cyclohexen-3-one;Seudenone;MCH;3-Methyl-2-cyclohexene-1-one;NSC 43632;3-Methyl-2-cyclohexenone
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CAS No:
Description
3-Methyl-2-cyclohexen-1-one is a nonaromatic cyclic ketone with a medicinal, phenolic, mild cherry aroma CLEAR VERY SLIGHTLY YELLOW TO BROWN LIQUIDMay be prepared by acid hydrolysis and decarboxylation of the corresponding 4-carbetoxy derivative; by oxidation of 1-methylcyclohex-l-ene with chromium trioxide in acetic acid; by cyclization of 3-carbetoxy-6-chlorohept-5-en-2-one with sulfuric acid.
Liquid|Clear liquid; medicinal, phenolic, mild cherry odour
3-Methyl-2-cyclohexen-1-one is a cyclic olefin.
3-Methyl-2-cyclohexen-1-one Basic Attributes
110.15
110.15
1560601
214-769-7
786Y352V9X
43632
DTXSID8035186
29142990
Characteristics
17.07000
1.04
Clear very slightly yellow to brown Liquid
0.978 g/cm3 @ Temp: 15 °C
-21 °C
201 °C
155 °F
n 20/D 1.494(lit.)
insoluble
2-8°C
Safety Information
9.2
3
22-36-20/21/22
36/37/39-26-24/25
GW7340000
Xn
P301 + P312 + P330
H302
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 279 companies from 4 notifications to the ECHA C&L Inventory.
3-Methyl-2-cyclohexen-1-one Use and Manufacturing
Sex pheromone of Douglas Fir beetle.
2-Cyclohexen-1-one, 3-methyl-: ACTIVE
Food additives -> Flavoring Agents
Flavoring Agents
Computed Properties
Molecular Weight:110.15
XLogP3:0.8
Hydrogen Bond Acceptor Count:1
Exact Mass:110.073164938
Monoisotopic Mass:110.073164938
Topological Polar Surface Area:17.1
Heavy Atom Count:8
Complexity:133
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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