Cas no 26998-80-1 (Phenol, trimethyl-)
Phenol, trimethyl- structure
Product Name:Phenol, trimethyl-
Phenol, trimethyl- Chemical and Physical Properties
Names and Identifiers
-
- Phenol, trimethyl-
- 2,3,4-trimethylphenol
- InChI=1/C9H12O/c1-6-4-5-9(10)8(3)7(6)2/h4-5,10H,1-3H
- Phenol, 2,3,4-trimethyl-
- 526-85-2
- 4-HYDROXY-1,2,3-TRIMETHYLBENZENE
- Q27271486
- UNII-9295A0BC1N
- 9295A0BC1N
- EINECS 248-158-1
- EINECS 208-399-5
- 2,3,4-HEMIMELLITENOL
- SCHEMBL207038
- 1-HYDROXY-2,3,4-TRIMETHYLBENZENE
- 26998-80-1
- NS00042889
- Trimethylphenol
- DTXSID80865331
-
- Inchi： 1S/C9H12O/c1-6-4-5-9(10)8(3)7(6)2/h4-5,10H,1-3H3
- InChI Key： XRUGBBIQLIVCSI-UHFFFAOYSA-N
- SMILES： OC1=CC=C(C)C(C)=C1C
Computed Properties
- Exact Mass: 136.08886
- Monoisotopic Mass: 136.088815002g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 111
- 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: 2.7
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- PSA: 20.23
Phenol, trimethyl- Related Literature
-
Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
-
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
-
Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
-
David B. Cordes,Alexandra M. Z. Slawin,Stefania Righetto,Denis Jacquemin,Eli Zysman-Colman,Véronique Guerchais Dalton Trans., 2018,47, 8292-8300
26998-80-1 (Phenol, trimethyl-) Related Products
- 1300-71-6(Dimethylphenol)
- 608-43-5(2,3-Xylohydroquinone)
- 527-55-9(4,5-Dimethylbenzene-1,3-diol)
- 1321-28-4(1,4-Benzenediol,dimethyl-)
- 654-42-2(2,6-Dimethylhydroquinone)
- 95-71-6(Methylhydroquinone)
- 527-35-5(Phenol,2,3,5,6-tetramethyl-)
- 700-13-0(Trimethylhydroquinone)
- 697-82-5(2,3,5-Trimethyphenol)
- 2416-94-6(2,3,6-Trimethylphenol)
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