Cas no 1818-08-2 (Phenol,4-(1-methylheptyl)-)
Phenol,4-(1-methylheptyl)- structure
Product Name:Phenol,4-(1-methylheptyl)-
Phenol,4-(1-methylheptyl)- Chemical and Physical Properties
Names and Identifiers
-
- Phenol,4-(1-methylheptyl)-
- 4-octan-2-ylphenol
- p-(1-methylheptyl)phenol
- 4-(octan-2-yl)phenol
- EINECS 248-759-9
- EINECS 217-332-9
- 27985-70-2
- EINECS 248-330-6
- Phenol,4-sec-octyl-(9ci)
- 27214-47-7
- DTXSID90939471
- NS00007187
- Phenol, (1-methylheptyl)-
- p-s-octylphenol
- 1818-08-2
- p-sec-Octylphenol
- SCHEMBL4410688
-
- Inchi： 1S/C14H22O/c1-3-4-5-6-7-12(2)13-8-10-14(15)11-9-13/h8-12,15H,3-7H2,1-2H3
- InChI Key： DJQPEGRPSMOYLI-UHFFFAOYSA-N
- SMILES： OC1C=CC(=CC=1)C(C)CCCCCC
Computed Properties
- Exact Mass: 206.16716
- Monoisotopic Mass: 206.167065321g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 6
- Complexity: 147
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 5.2
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- PSA: 20.23
Phenol,4-(1-methylheptyl)- Related Literature
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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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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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
1818-08-2 (Phenol,4-(1-methylheptyl)-) Related Products
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- 75520-41-1(Acetyl Coenzyme A Trilithium Salt)
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- 29799-07-3(4-(1-Adamantyl)phenol)
- 81936-33-6(4-(trans-4-Propylcyclohexyl)phenol)
- 80-46-6(4-Tert-Amylphenol)
- 77-40-7(Bisphenol B)
- 99-71-8(4-(butan-2-yl)phenol)
- 140-66-9(4-Tert-Octylphenol)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
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