Cas no 57495-17-7 (Cyclohexane,1,3-diethynyl-,trans-(9ci))
57495-17-7 structure
Product Name:Cyclohexane,1,3-diethynyl-,trans-(9ci)
CAS No:57495-17-7
MF:C10H12
MW:132.202282905579
CID:2188502
PubChem ID:45079190
Update Time:2025-04-21
Cyclohexane,1,3-diethynyl-,trans-(9ci) Chemical and Physical Properties
Names and Identifiers
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- Cyclohexane,1,3-diethynyl-,trans-(9ci)
- 57495-17-7
-
- Inchi： 1S/C10H12/c1-3-9-6-5-7-10(4-2)8-9/h1-2,9-10H,5-8H2/t9-,10-/m1/s1
- InChI Key： ZFNYENHXOKGAOJ-NXEZZACHSA-N
- SMILES： [C@@H]1(C#C)CCC[C@@H](C#C)C1
Computed Properties
- Exact Mass: 132.093900383Da
- Monoisotopic Mass: 132.093900383Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 173
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.9
- Topological Polar Surface Area: 0?2
Cyclohexane,1,3-diethynyl-,trans-(9ci) Related Literature
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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