Cas no 73532-70-4 (3-Cyclopentene-1-acetaldehyde, 2-formyl-α,3-dimethyl-, (1S,2R)-)
73532-70-4 structure
Product Name:3-Cyclopentene-1-acetaldehyde, 2-formyl-α,3-dimethyl-, (1S,2R)-
CAS No:73532-70-4
MF:C10H14O2
MW:166.216963291168
CID:574443
Update Time:2024-03-01
3-Cyclopentene-1-acetaldehyde, 2-formyl-α,3-dimethyl-, (1S,2R)- Chemical and Physical Properties
Names and Identifiers
-
- 3-Cyclopentene-1-acetaldehyde,2-formyl-a,3-dimethyl-, (1S,2R)-
- 3-Cyclopentene-1-acetaldehyde,2-formyl-a,3-dimethyl-, [1S-(1a,2a)]-
- Plagiodial
- CID 101410502
- 3-Cyclopentene-1-acetaldehyde, 2-formyl-α,3-dimethyl-, (1S,2R)-
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- Inchi： 1S/C10H14O2/c1-7-3-4-9(8(2)5-11)10(7)6-12/h3,5-6,8-10H,4H2,1-2H3
- InChI Key： SSICLPRUDVLZGR-UHFFFAOYSA-N
- SMILES： O=CC1C(C)=CCC1C(C=O)C
Computed Properties
- Exact Mass: 166.099
- Monoisotopic Mass: 166.099
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 218
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 3
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 34.1
Experimental Properties
- Density: 1.065±0.06 g/cm3(Predicted)
- Boiling Point: 254.6±33.0 °C(Predicted)
3-Cyclopentene-1-acetaldehyde, 2-formyl-α,3-dimethyl-, (1S,2R)- Related Literature
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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