Cas no 63865-64-5 (Cyclohexanone, 5-hydroxy-5-methyl-2-(1-methylethyl)-)
63865-64-5 structure
Product Name:Cyclohexanone, 5-hydroxy-5-methyl-2-(1-methylethyl)-
CAS No:63865-64-5
MF:C10H18O2
MW:170.248723506927
CID:1668532
PubChem ID:537586
Update Time:2025-04-21
Cyclohexanone, 5-hydroxy-5-methyl-2-(1-methylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexanone, 5-hydroxy-5-methyl-2-(1-methylethyl)-
- MITMEWYOGQSHSC-UHFFFAOYSA-N
- 5-Hydroxy-2-isopropyl-5-methylcyclohexanone #
- 5-Hydroxy-2-isopropyl-5-methylcyclohexanone
- 1-Hydroxy-p-menth-3-one
- SCHEMBL2683894
- 5-hydroxy-5-methyl-2-propan-2-ylcyclohexan-1-one
- 3-hydroxy-3-methyl-6-(1-methylethyl)cyclohexanone
- 63865-64-5
- AKOS015907564
-
- Inchi： 1S/C10H18O2/c1-7(2)8-4-5-10(3,12)6-9(8)11/h7-8,12H,4-6H2,1-3H3
- InChI Key： MITMEWYOGQSHSC-UHFFFAOYSA-N
- SMILES： OC1(C)CC(C(C(C)C)CC1)=O
Computed Properties
- Exact Mass: 170.13074
- Monoisotopic Mass: 170.130679813g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 186
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.3
- Topological Polar Surface Area: 37.3?2
Experimental Properties
- PSA: 37.3
Cyclohexanone, 5-hydroxy-5-methyl-2-(1-methylethyl)- Related Literature
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Bruce Parkinson Energy Environ. Sci., 2010,3, 509-511
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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