Cas no 67845-33-4 (1-tert-butyl-2-methoxy-3,5-dimethylbenzene)
67845-33-4 structure
Product Name:1-tert-butyl-2-methoxy-3,5-dimethylbenzene
CAS No:67845-33-4
MF:C13H20O
MW:192.297304153442
CID:1722226
PubChem ID:105757
Update Time:2025-04-21
1-tert-butyl-2-methoxy-3,5-dimethylbenzene Chemical and Physical Properties
Names and Identifiers
-
- 1-tert-butyl-2-methoxy-3,5-dimethylbenzene
- 2-tert-Butyl-4,6-dimethylphenyl methyl ether
- 6-tert-Butyl-2,4-dimethyl-1-methoxybenzene
- benzene, 1-(1,1-dimethylethyl)-2-methoxy-3,5-dimethyl-
- 1-(1,1-Dimethylethyl)-2-methoxy-3,5-dimethylbenzene
- 1-tert-Butyl-2-methoxy-3,5-dimethyl-benzene
- 67845-33-4
- PZISTOMBMFSTQA-UHFFFAOYSA-N
- DTXSID7070686
- 6-tert-Butyl-2,4-dimethylanisole
- SCHEMBL14594236
-
- Inchi： 1S/C13H20O/c1-9-7-10(2)12(14-6)11(8-9)13(3,4)5/h7-8H,1-6H3
- InChI Key： PZISTOMBMFSTQA-UHFFFAOYSA-N
- SMILES： O(C)C1C(C)=CC(C)=CC=1C(C)(C)C
Computed Properties
- Exact Mass: 192.1515
- Monoisotopic Mass: 192.151
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 180
- 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: 4.3
- Topological Polar Surface Area: 9.2?2
Experimental Properties
- Density: 0.904
- Boiling Point: 255.9°C at 760 mmHg
- Flash Point: 96.7°C
- Refractive Index: 1.485
- PSA: 9.23
1-tert-butyl-2-methoxy-3,5-dimethylbenzene Related Literature
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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