4-Butoxy-2,3-difluorophenol

C₁₀H₁₂F₂O₂CAS 136239-68-4202.20 g/mol

Open in Covalent MOL file

Aryl halide Ether Phenol

Properties

Molecular formula: C₁₀H₁₂F₂O₂
Molar mass: 202.20 g/mol
Exact mass: 202.0805 Da
logP: 2.85Crippen estimate
Polar surface area: 29.5 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 4

Identifiers

CAS number

136239-68-4

SMILES

CCCCOc1ccc(O)c(F)c1F

InChIKey

HQFTTYLLNVHBGT-UHFFFAOYSA-N

InChI

InChI=1S/C10H12F2O2/c1-2-3-6-14-8-5-4-7(13)9(11)10(8)12/h4-5,13H,2-3,6H2,1H3

Weigh it out

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

Names and synonyms

1 names

Phenol, 4-butoxy-2,3-difluoro-

Work with 4-Butoxy-2,3-difluorophenol

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

1-Hydroxy-4-ethoxy-2,3-difluorobenzene126163-56-271 % similar 1-Butoxy-2,3-difluorobenzene136239-66-256 % similar 1-Butoxy-2,3-difluoro-4-(trans-4-propylcyclohexyl)benzene208709-55-153 % similar 4-Butoxyphenol122-94-147 % similar B-(4-Ethoxy-2,3-difluorophenyl)boronic acid212386-71-542 % similar 4-(Heptyloxy)phenol13037-86-041 % similar 4-(Hexyloxy)phenol18979-55-041 % similar 4-(Octyloxy)phenol3780-50-541 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook