Cas no 868700-99-6 (Cyclopentanone, 2-(1-iodononylidene)-)
868700-99-6 structure
Product Name:Cyclopentanone, 2-(1-iodononylidene)-
CAS No:868700-99-6
MF:C14H23IO
MW:334.236296892166
CID:660310
PubChem ID:71413682
Update Time:2025-04-19
Cyclopentanone, 2-(1-iodononylidene)- Chemical and Physical Properties
Names and Identifiers
-
- Cyclopentanone, 2-(1-iodononylidene)-
- 2-(1-iodononylidene)cyclopentan-1-one
- 868700-99-6
- DTXSID00833193
-
- Inchi： 1S/C14H23IO/c1-2-3-4-5-6-7-10-13(15)12-9-8-11-14(12)16/h2-11H2,1H3
- InChI Key： IFTHQPOICQZZFC-UHFFFAOYSA-N
- SMILES： IC(CCCCCCCC)=C1C(CCC1)=O
Computed Properties
- Exact Mass: 334.07936g/mol
- Monoisotopic Mass: 334.07936g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 16
- Rotatable Bond Count: 7
- Complexity: 256
- 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
- XLogP3: 5.8
- Topological Polar Surface Area: 17.1?2
Cyclopentanone, 2-(1-iodononylidene)- Related Literature
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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