Cas no 1198-90-9 (Benzene,2-ethyl-4-methyl-1-(1-methylethyl)-)
1198-90-9 structure
Product Name:Benzene,2-ethyl-4-methyl-1-(1-methylethyl)-
CAS No:1198-90-9
MF:C12H18
MW:162.271323680878
CID:117501
PubChem ID:21956154
Update Time:2025-04-18
Benzene,2-ethyl-4-methyl-1-(1-methylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzene,2-ethyl-4-methyl-1-(1-methylethyl)-
- 2-ethyl-4-methyl-1-propan-2-ylbenzene
- Benzene, 2-ethyl-4-methyl-1-(1-methylethyl)- (9CI)
- 1198-90-9
- 2-Ethyl-4-methyl-1-(propan-2-yl)benzene
- DTXSID50620757
- 1-ethyl-3-methyl-6-(1-methylethyl)-benzene
-
- Inchi： 1S/C12H18/c1-5-11-8-10(4)6-7-12(11)9(2)3/h6-9H,5H2,1-4H3
- InChI Key： VYQWKXMBHSGIFX-UHFFFAOYSA-N
- SMILES： C(C)(C)C1C=CC(C)=CC=1CC
Computed Properties
- Exact Mass: 162.14094
- 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: 2
- Complexity: 126
- 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
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 4.2
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
Benzene,2-ethyl-4-methyl-1-(1-methylethyl)- Related Literature
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
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Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
1198-90-9 (Benzene,2-ethyl-4-methyl-1-(1-methylethyl)-) Related Products
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