Cas no 96857-25-9 (Benzene,1,2,3-trimethyl-4-(1-methylethyl)-)
96857-25-9 structure
Product Name:Benzene,1,2,3-trimethyl-4-(1-methylethyl)-
CAS No:96857-25-9
MF:C12H18
MW:162.271323680878
CID:800672
PubChem ID:18783375
Update Time:2025-04-19
Benzene,1,2,3-trimethyl-4-(1-methylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzene,1,2,3-trimethyl-4-(1-methylethyl)-
- 1,2,3-trimethyl-4-propan-2-ylbenzene
- Benzene, 1,2,3-trimethyl-4-(1-methylethyl)- (9CI)
- trimethyl-(1-methylethyl)-benzene
- 96857-25-9
- QHOPYXBAXVDHDW-UHFFFAOYSA-N
- AKOS006327496
- 1,2,3-Trimethyl-4-(propan-2-yl)benzene
- DTXSID00596216
- 1,2,3-Trimethyl-4-isopropylbenzene
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- Inchi： 1S/C12H18/c1-8(2)12-7-6-9(3)10(4)11(12)5/h6-8H,1-5H3
- InChI Key： QHOPYXBAXVDHDW-UHFFFAOYSA-N
- SMILES： C(C)(C)C1C=CC(C)=C(C)C=1C
Computed Properties
- Exact Mass: 162.140850574g/mol
- Monoisotopic Mass: 162.140850574g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 137
- 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: 4.7
- Topological Polar Surface Area: 0?2
Benzene,1,2,3-trimethyl-4-(1-methylethyl)- Related Literature
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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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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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
96857-25-9 (Benzene,1,2,3-trimethyl-4-(1-methylethyl)-) Related Products
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