6-(2-(2,6,6-Trimethyl-1-cyclohexen-1-yl)ethen-1-yl)-2-naphthalenecarboxylic acid

Base Information

Chemical Name:6-(2-(2,6,6-Trimethyl-1-cyclohexen-1-yl)ethen-1-yl)-2-naphthalenecarboxylic acid
CAS No.:86471-13-8
Molecular Formula:C22H24O2
Molecular Weight:320.431
Hs Code.:
Nikkaji Number:J448.296D
ChEMBL ID:CHEMBL39502
Mol file:86471-13-8.mol

Synonyms:6-(2-(2,6,6-trimethyl-1-cyclohexen-1-yl)ethen-1-yl)-2-naphthalenecarboxylic acid;6-TCENA

Suppliers and Price of 6-(2-(2,6,6-Trimethyl-1-cyclohexen-1-yl)ethen-1-yl)-2-naphthalenecarboxylic acid

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
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price

Total 3 raw suppliers

Chemical Property of 6-(2-(2,6,6-Trimethyl-1-cyclohexen-1-yl)ethen-1-yl)-2-naphthalenecarboxylic acid

Chemical Property:

Vapor Pressure:2.43E-10mmHg at 25°C
Melting Point:173-174 °C(Solv: ethyl acetate (141-78-6); hexane (110-54-3))
Boiling Point:488.1°C at 760 mmHg
PKA:4.25±0.30(Predicted)
Flash Point:225.8°C
PSA：37.30000
Density:1.148g/cm³
LogP:6.07780
XLogP3:5.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:320.177630004
Heavy Atom Count:24
Complexity:540

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=C(C(CCC1)(C)C)C=CC2=CC3=C(C=C2)C=C(C=C3)C(=O)O
Isomeric SMILES:CC1=C(C(CCC1)(C)C)/C=C/C2=CC3=C(C=C2)C=C(C=C3)C(=O)O

Technology Process of 6-(2-(2,6,6-Trimethyl-1-cyclohexen-1-yl)ethen-1-yl)-2-naphthalenecarboxylic acid

There total 3 articles about 6-(2-(2,6,6-Trimethyl-1-cyclohexen-1-yl)ethen-1-yl)-2-naphthalenecarboxylic acid which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 75.0%

: 86471-12-7
methyl 6-<(E)-2-(2,6,6-trimethyl-1-cyclohexen-1-yl)ethen-1-yl>-2-naphthalenecarboxylate

: 86471-13-8
(E)-6-[2-(2,6,6-trimethyl-1-cyclohexen-1-yl)ethenyl]-2-naphthalenecarboxylic acid

Guidance literature:: With potassium hydroxide; In methanol; water; for 0.5h; Heating;
DOI:10.1021/jm00365a021

Reference yield:

: 7567-87-5
6-formyl-2-naphthalenecarboxylic acid methyl ester

: 86471-13-8
(E)-6-[2-(2,6,6-trimethyl-1-cyclohexen-1-yl)ethenyl]-2-naphthalenecarboxylic acid

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) n-BuLi / 1.) THF, hexane, 0 deg C, 20 min, 2.) THF, RT, 24 h

2: 75 percent / KOH / methanol; H₂O / 0.5 h / Heating

With potassium hydroxide; n-butyllithium; In methanol; water;
DOI:10.1021/jm00365a021

Reference yield:

: 56013-01-5
triphenyl((2,6,6-trimethylcyclohex-1-enyl)methyl)phosphonium bromide

: 86471-13-8
(E)-6-[2-(2,6,6-trimethyl-1-cyclohexen-1-yl)ethenyl]-2-naphthalenecarboxylic acid

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) n-BuLi / 1.) THF, hexane, 0 deg C, 20 min, 2.) THF, RT, 24 h

2: 75 percent / KOH / methanol; H₂O / 0.5 h / Heating

With potassium hydroxide; n-butyllithium; In methanol; water;
DOI:10.1021/jm00365a021