Cas no 121141-88-6 (heptacos-8-ene)
heptacos-8-ene structure
Product Name:heptacos-8-ene
CAS No:121141-88-6
MF:C27H54
MW:378.717669010162
CID:2617382
PubChem ID:71339850
Update Time:2025-04-21
heptacos-8-ene Chemical and Physical Properties
Names and Identifiers
-
- heptacos-8-ene
- 121141-88-6
- DTXCID10717930
- HJAAAROXSYMFRJ-UHFFFAOYSA-N
- DTXSID60767187
-
- Inchi： 1S/C27H54/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-26-24-22-20-18-16-14-12-10-8-6-4-2/h15,17H,3-14,16,18-27H2,1-2H3
- InChI Key： HJAAAROXSYMFRJ-UHFFFAOYSA-N
- SMILES： C(CCCCCCCCC)CCCCCCCCC=CCCCCCCC
Computed Properties
- Exact Mass: 378.422551722Da
- Monoisotopic Mass: 378.422551722Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 27
- Rotatable Bond Count: 23
- Complexity: 265
- 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: 13.9
- Topological Polar Surface Area: 0?2
heptacos-8-ene 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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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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