Cas no 107811-47-2 (Benzene,1,2-diethoxy-4-(1-methylethoxy)-)
107811-47-2 structure
Product Name:Benzene,1,2-diethoxy-4-(1-methylethoxy)-
CAS No:107811-47-2
MF:C13H20O3
MW:224.296104431152
CID:206735
PubChem ID:183878
Update Time:2025-04-19
Benzene,1,2-diethoxy-4-(1-methylethoxy)- Chemical and Physical Properties
Names and Identifiers
-
- Benzene,1,2-diethoxy-4-(1-methylethoxy)-
- 1,2-diethoxy-4-propan-2-yloxybenzene
- 1,2-Diethoxy-4-(1-methylethoxy)benzene
- DTXSID50148284
- 107811-47-2
- Benzene, 1,2-diethoxy-4-(1-methylethoxy)-
-
- Inchi： 1S/C13H20O3/c1-5-14-12-8-7-11(16-10(3)4)9-13(12)15-6-2/h7-10H,5-6H2,1-4H3
- InChI Key： JKXORXJOHIZOAK-UHFFFAOYSA-N
- SMILES： O(C1C=CC(=C(C=1)OCC)OCC)C(C)C
Computed Properties
- Exact Mass: 224.1413
- Monoisotopic Mass: 224.141
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 6
- Complexity: 182
- 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: 3.6
- Topological Polar Surface Area: 27.7?2
Experimental Properties
- Density: 0.984
- Boiling Point: 302.9°Cat760mmHg
- Flash Point: 100.9°C
- Refractive Index: 1.48
- PSA: 27.69
- LogP: 3.27120
Benzene,1,2-diethoxy-4-(1-methylethoxy)- Related Literature
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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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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