Cas no 88640-66-8 (Phenol, 3-ethyl-5-methoxy-)
Phenol, 3-ethyl-5-methoxy- structure
Product Name:Phenol, 3-ethyl-5-methoxy-
CAS No:88640-66-8
MF:C9H12O2
MW:152.190382957458
CID:625854
PubChem ID:22145551
Update Time:2025-04-19
Phenol, 3-ethyl-5-methoxy- Chemical and Physical Properties
Names and Identifiers
-
- Phenol, 3-ethyl-5-methoxy-
- 3-ethyl-5-methoxyphenol
- SCHEMBL5880258
- 3-ethyl-5-methoxy-phenol
- 88640-66-8
- MB23713
- DTXSID00622903
-
- Inchi： 1S/C9H12O2/c1-3-7-4-8(10)6-9(5-7)11-2/h4-6,10H,3H2,1-2H3
- InChI Key： VKVVAKAEARYUDV-UHFFFAOYSA-N
- SMILES： O(C)C1=CC(=CC(=C1)CC)O
Computed Properties
- Exact Mass: 152.083729621g/mol
- Monoisotopic Mass: 152.083729621g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 114
- 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: 2.3
- Topological Polar Surface Area: 29.5?2
Phenol, 3-ethyl-5-methoxy- Related Literature
-
Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
-
Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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