Cas no 6925-42-4 (4-(3-hexyl)phenol)
4-(3-hexyl)phenol structure
Product Name:4-(3-hexyl)phenol
4-(3-hexyl)phenol Chemical and Physical Properties
Names and Identifiers
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- 4-(3-hexyl)phenol
- 4-hexan-3-ylphenol
- 6925-42-4
- SCHEMBL15427906
- DTXSID40988974
- 4-(Hexan-3-yl)phenol
- NCIOpen2_007234
-
- Inchi： 1S/C12H18O/c1-3-5-10(4-2)11-6-8-12(13)9-7-11/h6-10,13H,3-5H2,1-2H3
- InChI Key： AFXYCMIKKCWXCT-UHFFFAOYSA-N
- SMILES： OC1C=CC(=CC=1)C(CC)CCC
Computed Properties
- Exact Mass: 178.135765193g/mol
- Monoisotopic Mass: 178.135765193g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 125
- 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: 4.2
- Topological Polar Surface Area: 20.2?2
4-(3-hexyl)phenol Related Literature
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
6925-42-4 (4-(3-hexyl)phenol) Related Products
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