Cas no 57344-26-0 (Phenol, 4-(5-phenylpentyl)-)
Phenol, 4-(5-phenylpentyl)- structure
Product Name:Phenol, 4-(5-phenylpentyl)-
CAS No:57344-26-0
MF:C17H20O
MW:240.340105056763
CID:345698
PubChem ID:14086159
Update Time:2025-04-19
Phenol, 4-(5-phenylpentyl)- Chemical and Physical Properties
Names and Identifiers
-
- Phenol, 4-(5-phenylpentyl)-
- 4-(5-phenylpentyl)phenol
- 57344-26-0
- DTXSID40555620
- SCHEMBL1841357
-
- Inchi： 1S/C17H20O/c18-17-13-11-16(12-14-17)10-6-2-5-9-15-7-3-1-4-8-15/h1,3-4,7-8,11-14,18H,2,5-6,9-10H2
- InChI Key： QMEJLBAKRCZJSZ-UHFFFAOYSA-N
- SMILES： OC1C=CC(=CC=1)CCCCCC1C=CC=CC=1
Computed Properties
- Exact Mass: 240.1515
- Monoisotopic Mass: 240.151415257g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 18
- Rotatable Bond Count: 6
- Complexity: 200
- 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
- XLogP3: 5.4
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- PSA: 20.23
Phenol, 4-(5-phenylpentyl)- Related Literature
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
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