Cas no 62871-06-1 (3-Dodecene, 12-chloro-)
3-Dodecene, 12-chloro- structure
Product Name:3-Dodecene, 12-chloro-
CAS No:62871-06-1
MF:C12H23Cl
MW:202.764023065567
CID:429619
Update Time:2024-01-29
3-Dodecene, 12-chloro- Chemical and Physical Properties
Names and Identifiers
-
- 3-Dodecene, 12-chloro-
- 12-chlorododec-3-ene
-
- Inchi： 1S/C12H23Cl/c1-2-3-4-5-6-7-8-9-10-11-12-13/h3-4H,2,5-12H2,1H3
- InChI Key： PQHDAEGEYYIOKD-UHFFFAOYSA-N
- SMILES： CCC=CCCCCCCCCCl
Computed Properties
- Exact Mass: 202.14899
- Monoisotopic Mass: 202.149
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 13
- Rotatable Bond Count: 9
- Complexity: 108
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- Topological Polar Surface Area: 0A^2
Experimental Properties
- Density: 0.875±0.06 g/cm3(Predicted)
- Boiling Point: 264.4±19.0 °C(Predicted)
- PSA: 0
3-Dodecene, 12-chloro- Related Literature
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Tanya Ostapenko,Peter J. Collings,Samuel N. Sprunt,J. T. Gleeson Soft Matter, 2013,9, 9487-9498
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Hailing Chen,Lu Yin,Meng Liu,Laibing Wang,Michiya Fujiki,Wei Zhang RSC Adv., 2019,9, 4849-4856
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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