Cas no 65180-39-4 (Phenol, 4-(2-hydroxyethoxy)-3-methyl-)
65180-39-4 structure
Product Name:Phenol, 4-(2-hydroxyethoxy)-3-methyl-
CAS No:65180-39-4
MF:C9H12O3
MW:168.189783096313
CID:389271
PubChem ID:57249988
Update Time:2025-04-19
Phenol, 4-(2-hydroxyethoxy)-3-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Phenol, 4-(2-hydroxyethoxy)-3-methyl-
- 4-(2-hydroxyethoxy)-3-methylphenol
- 65180-39-4
- SCHEMBL9651856
- DTXSID30720668
-
- Inchi： 1S/C9H12O3/c1-7-6-8(11)2-3-9(7)12-5-4-10/h2-3,6,10-11H,4-5H2,1H3
- InChI Key： GLRZIUBEUWKWHQ-UHFFFAOYSA-N
- SMILES： O(CCO)C1C=CC(=CC=1C)O
Computed Properties
- Exact Mass: 168.078644241g/mol
- Monoisotopic Mass: 168.078644241g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 127
- 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: 1.2
- Topological Polar Surface Area: 49.7?2
Phenol, 4-(2-hydroxyethoxy)-3-methyl- Related Literature
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
-
Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
-
Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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