Cas no 62688-94-2 (1-Butene, 1,1-dichloro-2-methoxy-3-methyl-)
62688-94-2 structure
Product Name:1-Butene, 1,1-dichloro-2-methoxy-3-methyl-
CAS No:62688-94-2
MF:C6H10Cl2O
MW:169.049000263214
CID:435087
PubChem ID:14399475
Update Time:2025-04-19
1-Butene, 1,1-dichloro-2-methoxy-3-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 1-Butene, 1,1-dichloro-2-methoxy-3-methyl-
- 1,1-dichloro-2-methoxy-3-methylbut-1-ene
- DTXSID90559835
- 62688-94-2
-
- Inchi： 1S/C6H10Cl2O/c1-4(2)5(9-3)6(7)8/h4H,1-3H3
- InChI Key： RQWJTMXSKZYUCF-UHFFFAOYSA-N
- SMILES： Cl/C(=C(/C(C)C)\OC)/Cl
Computed Properties
- Exact Mass: 168.011
- Monoisotopic Mass: 168.0108703g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 9
- Rotatable Bond Count: 2
- Complexity: 114
- 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: 3.1
- Topological Polar Surface Area: 9.2?2
Experimental Properties
- PSA: 9.23
1-Butene, 1,1-dichloro-2-methoxy-3-methyl- Related Literature
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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4. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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5. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
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