Cas no 156764-63-5 (1,3-Cyclopentadiene, 1,2,4-tris(1-methylethyl)-)
156764-63-5 structure
Product Name:1,3-Cyclopentadiene, 1,2,4-tris(1-methylethyl)-
CAS No:156764-63-5
MF:C14H24
MW:192.340364456177
CID:3801509
PubChem ID:11116885
Update Time:2025-04-22
1,3-Cyclopentadiene, 1,2,4-tris(1-methylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Cyclopentadiene, 1,2,4-tris(1-methylethyl)-
- 1,2,4-triisopropylcyclopenta-1,3-diene
- 1,2,4-Tri-iso-Propylcyclopentadiene
- 156764-63-5
- 1,2,4-tri(propan-2-yl)cyclopenta-1,3-diene
- 1,2,4-Triisopropyl-1,3-cyclopentadiene
-
- Inchi： 1S/C14H24/c1-9(2)12-7-13(10(3)4)14(8-12)11(5)6/h7,9-11H,8H2,1-6H3
- InChI Key： OQVCGWWXGYBONT-UHFFFAOYSA-N
- SMILES： C1(C(C)C)CC(C(C)C)=CC=1C(C)C
Computed Properties
- Exact Mass: 192.187800766Da
- Monoisotopic Mass: 192.187800766Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 262
- 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: 3.9
- Topological Polar Surface Area: 0?2
Experimental Properties
- Density: 0.852±0.06 g/cm3 (20 oC 760 Torr),
- Boiling Point: 243.1±7.0 oC (760 Torr),
- Flash Point: 91.8±13.0 oC,
- Solubility: Insuluble (1.7E-5 g/L) (25 oC),
1,3-Cyclopentadiene, 1,2,4-tris(1-methylethyl)- Related Literature
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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