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Dodecanoic acid, 12-fluoro-, ethyl ester

HCID 9764
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Basic information

CAS
373-26-2
Standard SMILES
CCOC(=O)CCCCCCCCCCCF
InChIKey
UZDAUCVVNDPNCN-UHFFFAOYSA-N
Molecular formula
C14H27FO2
Average molar mass
246.36 g/mol
Monoisotopic mass
246.19950826

Names & identifiers

Preferred name
Dodecanoic acid, 12-fluoro-, ethyl ester
IUPAC
ethyl 12-fluorododecanoate
English name
12-Fluorododecanoic acid ethyl ester
Molecular formula
C14H27FO2
Molecular weight
246.36

Names & synonyms

Ethyl 12-fluorododecanoate373-26-2BRN 1778867DODECANOIC ACID, 12-FLUORO-, ETHYL ESTERDTXSID101907493-02-00-00896 (Beilstein Handbook Reference)RefChem:339471DTXCID0011324012-Fluorolauric acid ethyl ester12-Fluorododecanoic acid ethyl ester

Database identifiers

CAS
373-26-2
PubChem CID
9764
DTXSID
DTXSID10190749
Nikkaji
J42.968F

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
13
Heavy atoms
17
Formal charge
0
Complexity
172

Related reactions

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Compound notes

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