chempirical

Perfluorotetradecanoic acid

C14HF27O2CAS 376-06-7714.12 g/mol

Open in Covalent MOL file
OOHFFFFFFFFFFFFFFFFFFFFFFFFFFF
Alkyl halideCarboxylic acid

Properties

Molecular formula
C14HF27O2
Molar mass
714.12 g/mol
Exact mass
713.9545 Da
logP
8.26Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
12

Identifiers

CAS number
376-06-7
SMILES
O=C(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIKey
RUDINRUXCKIXAJ-UHFFFAOYSA-N
InChI
InChI=1S/C14HF27O2/c15-2(16,1(42)43)3(17,18)4(19,20)5(21,22)6(23,24)7(25,26)8(27,28)9(29,30)10(31,32)11(33,34)12(35,36)13(37,38)14(39,40)41/h(H,42,43)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

7 names
  • Tetradecanoic acid, 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-heptacosafluoro-
  • Tetradecanoic acid, heptacosafluoro-
  • 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-Heptacosafluorotetradecanoic acid
  • Perfluoromyristic acid
  • Perfluorotetradecanecarboxylic acid
  • PFTeDA
  • Perfluoro-n-tetradecanoic acid

Work with Perfluorotetradecanoic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Perfluorooctadecanoic acid16517-11-6100 % similar Perfluorohexanoic acid307-24-4100 % similar Perfluorododecanoic acid307-55-1100 % similar Perfluorooctanoic acid335-67-1100 % similar Perfluorodecanoic acid335-76-2100 % similar Perfluoroheptanoic acid375-85-9100 % similar Perfluorononanoic acid375-95-1100 % similar Perfluorohexadecanoic acid67905-19-5100 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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