Cas no 91967-65-6 (Benzenemethanol,5-methyl-2-(1-methylethyl)-)
91967-65-6 structure
Product Name:Benzenemethanol,5-methyl-2-(1-methylethyl)-
CAS No:91967-65-6
MF:C11H16O
MW:164.244143486023
CID:800255
Update Time:2022-09-22
Benzenemethanol,5-methyl-2-(1-methylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzenemethanol,5-methyl-2-(1-methylethyl)-
- p-Cymene-3-methanol (7CI)
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- Inchi： 1S/C11H16O/c1-8(2)11-5-4-9(3)6-10(11)7-12/h4-6,8,12H,7H2,1-3H3
- InChI Key： QEJAXGNUBHRPPQ-UHFFFAOYSA-N
- SMILES： CC1=CC=C(C(C)C)C(CO)=C1
Computed Properties
- Exact Mass: 164.12
- Monoisotopic Mass: 164.12
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 131
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 20.2A^2
Benzenemethanol,5-methyl-2-(1-methylethyl)- Related Literature
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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