chempirical

2-(Difluoromethoxy)benzaldehyde

C8H6F2O2CAS 71653-64-0172.13 g/mol

Open in Covalent MOL file
OOFF
AldehydeAlkyl halideEther

Properties

Molecular formula
C8H6F2O2
Molar mass
172.13 g/mol
Exact mass
172.0336 Da
Boiling point
94–96 °C (at 10 Torr)
logP
2.10Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
3

Identifiers

CAS number
71653-64-0
SMILES
O=Cc1ccccc1OC(F)F
InChIKey
QPBNHDFPMRENBC-UHFFFAOYSA-N
InChI
InChI=1S/C8H6F2O2/c9-8(10)12-7-4-2-1-3-6(7)5-11/h1-5,8H

Weigh it out

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

Names and synonyms

2 names
  • Benzaldehyde, 2-(difluoromethoxy)-
  • o-(Difluoromethoxy)benzaldehyde

Work with 2-(Difluoromethoxy)benzaldehyde

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

Same formula

3,5-Difluoro-2-methylbenzoic acid1003710-06-2 2,5-Difluoro-4-methylbenzoic acid103877-80-1 3,5-Difluorophenylacetic acid105184-38-1 Methyl 2,4-difluorobenzoate106614-28-2 2,4-Difluoro-3-methylbenzoic acid112857-68-8 2,3-Difluorobenzeneacetic acid145689-41-4 4,5-Difluoro-2-methylbenzoic acid183237-86-7 Methyl 3,4-difluorobenzoate369-25-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook