Cas no 502497-40-7 (Dodecanoic acid, 2,2-difluoro-, ethyl ester)
502497-40-7 structure
Product Name:Dodecanoic acid, 2,2-difluoro-, ethyl ester
CAS No:502497-40-7
MF:C14H26F2O2
MW:264.351851940155
CID:2829189
PubChem ID:11380059
Update Time:2025-04-21
Dodecanoic acid, 2,2-difluoro-, ethyl ester Chemical and Physical Properties
Names and Identifiers
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- DTXSID80464126
- DTXCID40414945
- Dodecanoic acid, 2,2-difluoro-, ethyl ester
- BOGFKPNSGGDEIF-UHFFFAOYSA-N
- 502497-40-7
-
- Inchi： 1S/C14H26F2O2/c1-3-5-6-7-8-9-10-11-12-14(15,16)13(17)18-4-2/h3-12H2,1-2H3
- InChI Key： BOGFKPNSGGDEIF-UHFFFAOYSA-N
- SMILES： FC(C(=O)OCC)(CCCCCCCCCC)F
Computed Properties
- Exact Mass: 264.19008639Da
- Monoisotopic Mass: 264.19008639Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 12
- Complexity: 218
- 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: 6.2
- Topological Polar Surface Area: 26.3?2
Dodecanoic acid, 2,2-difluoro-, ethyl ester Related Literature
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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