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Decanoic acid, 10-fluoro-, ethyl ester

HCID 9611
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Basic information

CAS
353-03-7
Standard SMILES
CCOC(=O)CCCCCCCCCF
InChIKey
BHAONKMEXKSRAO-UHFFFAOYSA-N
Molecular formula
C12H23FO2
Average molar mass
218.31 g/mol
Monoisotopic mass
218.16820813

Names & identifiers

Preferred name
Decanoic acid, 10-fluoro-, ethyl ester
IUPAC
ethyl 10-fluorodecanoate

Names & synonyms

Ethyl 10-fluorodecanoate10-Fluorodecanoic acid ethyl ester353-03-7Ethyl 9-fluorononanecarboxylateEthyl omega-fluorodecanoateDECANOIC ACID, 10-FLUORO-, ETHYL ESTERBRN 1771473DTXSID201887934-02-00-01051 (Beilstein Handbook Reference)RefChem:336736DTXCID80111284

Database identifiers

CAS
353-03-7
PubChem CID
9611
DTXSID
DTXSID20188793
Nikkaji
J40.816F

Properties

Computed structural properties

XLogP
4
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
11
Heavy atoms
15
Formal charge
0
Complexity
149

Related reactions

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Compound notes

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