- An improved synthesis of benzocycloalkanone derivativesWada, Akimori; Sawada, Kyoko; Ono, Naomi; Ito, Masayoshi, Chemical & Pharmaceutical Bulletin, 2004, 52(1), 132-135
Cas no 107054-64-8 (8,8-Dimethyl-1,2,3,4,5,6,7,8-octahydronaphthalene-2-one)
107054-64-8 structure
Product Name:8,8-Dimethyl-1,2,3,4,5,6,7,8-octahydronaphthalene-2-one
CAS No:107054-64-8
MF:C12H18O
MW:178.270723819733
CID:2872409
Update Time:2023-08-10
8,8-Dimethyl-1,2,3,4,5,6,7,8-octahydronaphthalene-2-one Chemical and Physical Properties
Names and Identifiers
-
- 8,8-dimethyl-1,2,3,4,5,6,7,8-octahydronaphthalene-2-one
- 2(1H)-Naphthalenone, 3,4,5,6,7,8-hexahydro-8,8-dimethyl-
- 3,4,5,6,7,8-Hexahydro-8,8-dimethylnaphthalene-2(1H)-one
- 8,8-Dimethyl-1,2,3,4,5,6,7,8-octahydronaphthalene-2-one
-
- Inchi: 1S/C12H18O/c1-12(2)7-3-4-9-5-6-10(13)8-11(9)12/h3-8H2,1-2H3
- InChI Key: GQAIIAKEMJZLEA-UHFFFAOYSA-N
- SMILES: O=C1CCC2CCCC(C)(C)C=2C1
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 271
- XLogP3: 2.1
- Topological Polar Surface Area: 17.1
8,8-Dimethyl-1,2,3,4,5,6,7,8-octahydronaphthalene-2-one Production Method
Production Method 1
Reaction Conditions
1.1 Reagents: Lithium bis(trimethylsilyl)amide Solvents: Tetrahydrofuran ; 2 h, -70 °C
1.2 Reagents: Ammonium chloride Solvents: Water
1.3 Reagents: Azobisisobutyronitrile , Tributylstannane Solvents: Toluene ; 10 min, reflux
1.2 Reagents: Ammonium chloride Solvents: Water
1.3 Reagents: Azobisisobutyronitrile , Tributylstannane Solvents: Toluene ; 10 min, reflux
Reference
Production Method 2
Reaction Conditions
1.1 Reagents: Potassium tert-butoxide Solvents: o-Xylene
1.2 Reagents: Ammonium chloride Solvents: Water
1.3 Reagents: Magnesium chloride Solvents: Dimethyl sulfoxide
1.2 Reagents: Ammonium chloride Solvents: Water
1.3 Reagents: Magnesium chloride Solvents: Dimethyl sulfoxide
Reference
- Retinoids and related compounds. Part 26. Synthesis of (11Z)-8,18-propano- and methano-retinals and conformational study of the rhodopsin chromophoreWada, Akimori; Tsutsumi, Masako; Inatomi, Yuka; Imai, Hiroo; Shichida, Yoshinori; et al, Journal of the Chemical Society, 2001, (19), 2430-2439
8,8-Dimethyl-1,2,3,4,5,6,7,8-octahydronaphthalene-2-one Raw materials
- Acetic acid, 2-[2,2-dimethyl-6-[2-(phenylsulfonyl)ethyl]cyclohexylidene]-, ethyl ester
- Ethyl 6,6-dimethyl-2-[2-(phenylsulfonyl)ethyl]-1-cyclohexene-1-acetate
- Ethyl (2E)-2-(2-ethoxy-2-oxoethylidene)-3,3-dimethylcyclohexanepropanoate
- Ethyl 2-(2-ethoxy-2-oxoethyl)-3,3-dimethyl-1-cyclohexene-1-propanoate
8,8-Dimethyl-1,2,3,4,5,6,7,8-octahydronaphthalene-2-one Preparation Products
8,8-Dimethyl-1,2,3,4,5,6,7,8-octahydronaphthalene-2-one Related Literature
-
Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
-
Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
-
Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
-
Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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