Cas no 408312-58-3 (Benzene, 2,4-diethoxy-1-(2-propenyl)- (9CI))
408312-58-3 structure
Product Name:Benzene, 2,4-diethoxy-1-(2-propenyl)- (9CI)
CAS No:408312-58-3
MF:C13H18O2
MW:206.280824184418
CID:1022764
PubChem ID:24770086
Update Time:2025-04-20
Benzene, 2,4-diethoxy-1-(2-propenyl)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 2,4-diethoxy-1-(2-propenyl)- (9CI)
- 2,4-diethoxy-1-prop-2-enylbenzene
- 2,4-Diethoxy-1-(prop-2-en-1-yl)benzene
- BENZENE, 2,4-DIETHOXY-1-(2-PROPENYL)-
- 408312-58-3
- DTXSID00647232
- SCHEMBL2846105
- DB-285311
-
- Inchi： 1S/C13H18O2/c1-4-7-11-8-9-12(14-5-2)10-13(11)15-6-3/h4,8-10H,1,5-7H2,2-3H3
- InChI Key： JMAPVSDYWDGPKF-UHFFFAOYSA-N
- SMILES： O(CC)C1C=C(C=CC=1CC=C)OCC
Computed Properties
- Exact Mass: 206.130679813g/mol
- Monoisotopic Mass: 206.130679813g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 6
- Complexity: 179
- 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: 3.7
- Topological Polar Surface Area: 18.5?2
Benzene, 2,4-diethoxy-1-(2-propenyl)- (9CI) Related Literature
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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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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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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