Cas no 22805-71-6 (2-Butene,1,4-dimethoxy-, (2E)-)
22805-71-6 structure
Product Name:2-Butene,1,4-dimethoxy-, (2E)-
CAS No:22805-71-6
MF:C6H12O2
MW:116.158282279968
CID:251095
PubChem ID:5362882
Update Time:2025-04-19
2-Butene,1,4-dimethoxy-, (2E)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Butene,1,4-dimethoxy-, (2E)-
- TRANS-1,4-DIMETHOXY-2-BUTENE
- (E)-1,4-dimethoxy-2-butene
- 1,4-dimethoxy-2-butene
- 1,4-Dimethoxy-9,10-dihydroxy-anthracen
- 1,4-Dimethoxy-anthracen-9,10-diol
- 1,4-dimethoxy-anthracene-9,10-diol
- 1,4-dimethoxy-but-2t-ene
- AC1L7KUM
- Leuko-1,4-dimethoxy-anthrachinon
- NSC221270
- trans-1.4-Dimethoxy-buten-(2)
- trans-1.4-dimethoxy-butene-(2)
- SCHEMBL1059082
- SCHEMBL13313115
- 2-Butene, 1,4-dimethoxy-
- RXNMLQHZBCJMBA-ONEGZZNKSA-N
- 2-Butene-1,4-diol, dimethyl ether
- 1,4-dimethoxybut-2-ene
- AKOS006275467
- 22805-71-6
- (E)-1,4-dimethoxybut-2-ene
-
- Inchi： 1S/C6H12O2/c1-7-5-3-4-6-8-2/h3-4H,5-6H2,1-2H3/b4-3+
- InChI Key： RXNMLQHZBCJMBA-ONEGZZNKSA-N
- SMILES： O(C)C/C=C/COC
Computed Properties
- Exact Mass: 116.083729621g/mol
- Monoisotopic Mass: 116.083729621g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 8
- Rotatable Bond Count: 4
- Complexity: 51.5
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.2
- Topological Polar Surface Area: 18.5?2
Experimental Properties
- PSA: 18.46000
- LogP: 0.83540
2-Butene,1,4-dimethoxy-, (2E)- Related Literature
-
Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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