Cas no 125796-96-5 (Benzene,1-(1,1-dimethylethyl)-3-[2-[4-(2-ethylbutyl)phenoxy]ethoxy]-)
![Benzene,1-(1,1-dimethylethyl)-3-[2-[4-(2-ethylbutyl)phenoxy]ethoxy]- structure](https://ossimg.kuujia.com/scimg/126000/125796-96-5x500.png)
125796-96-5 structure
Product Name:Benzene,1-(1,1-dimethylethyl)-3-[2-[4-(2-ethylbutyl)phenoxy]ethoxy]-
CAS No:125796-96-5
MF:C24H34O2
MW:354.525567531586
CID:218749
PubChem ID:180390
Update Time:2025-04-19
Benzene,1-(1,1-dimethylethyl)-3-[2-[4-(2-ethylbutyl)phenoxy]ethoxy]- Chemical and Physical Properties
Names and Identifiers
-
- Benzene,1-(1,1-dimethylethyl)-3-[2-[4-(2-ethylbutyl)phenoxy]ethoxy]-
- 1-tert-butyl-3-[2-[4-(2-ethylbutyl)phenoxy]ethoxy]benzene
- 125796-96-5
- DTXSID70154928
- Benzene, 1-(1,1-dimethylethyl)-3-(2-(4-(2-ethylbutyl)phenoxy)ethoxy)-
-
- Inchi： 1S/C24H34O2/c1-6-19(7-2)17-20-11-13-22(14-12-20)25-15-16-26-23-10-8-9-21(18-23)24(3,4)5/h8-14,18-19H,6-7,15-17H2,1-5H3
- InChI Key： VBMUQPBVHSBXCW-UHFFFAOYSA-N
- SMILES： O(CCOC1C=CC(=CC=1)CC(CC)CC)C1=CC=CC(=C1)C(C)(C)C
Computed Properties
- Exact Mass: 354.25602
- Monoisotopic Mass: 354.255880323g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 26
- Rotatable Bond Count: 10
- Complexity: 361
- 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: 7.9
- Topological Polar Surface Area: 18.5?2
Experimental Properties
- PSA: 18.46
Benzene,1-(1,1-dimethylethyl)-3-[2-[4-(2-ethylbutyl)phenoxy]ethoxy]- Related Literature
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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