1,3,6-Cycloheptatriene-1-carboxylicacid, 5,5-dimethyl-

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Names

[ CAS No. ]:
499-89-8

[ Name ]:
1,3,6-Cycloheptatriene-1-carboxylicacid, 5,5-dimethyl-

[Synonym ]:
Thuja-Saeure
5,5-dimethyl-1,3,6-cycloheptatriene-1-carboxylic acid
dehydroperillic acid
Thujic acid
5,5-Dimethyl-cyclohepta-1,3,6-triencarbonsaeure
Thujinsaeure
5,5-dimethyl-cyclohepta-1,3,6-trienecarboxylic acid

Chemical & Physical Properties

[ Density]:
1.075g/cm3

[ Boiling Point ]:
285.7ºC at 760mmHg

[ Molecular Formula ]:
C₁₀H₁₂O₂

[ Molecular Weight ]:
164.20100

[ Flash Point ]:
133.7ºC

[ Exact Mass ]:
164.08400

[ PSA ]:
37.30000

[ LogP ]:
2.14960

[ Vapour Pressure ]:
0.000708mmHg at 25°C

[ Index of Refraction ]:
1.521

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

acetic acid-(5,5-dimethyl-cyclohepta-1,3,6-trienylmethyl ester)
1-bromo-4,4-dimethyl-cycloheptanecarboxylic acid

DownStream

2,2-Dimethylmalonic acid
4-Isopropylbenzoic acid