chempirical

1-Iodo-3-fluoropropane

C3H6FICAS 462-40-8187.98 g/mol

Open in Covalent MOL file
FI
Alkyl halide

Properties

Molecular formula
C3H6FI
Molar mass
187.98 g/mol
Exact mass
187.9498 Da
logP
1.78Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
462-40-8
SMILES
C(CF)CI
InChIKey
URBUZQPPQLQHBZ-UHFFFAOYSA-N
InChI
InChI=1S/C3H6FI/c4-2-1-3-5/h1-3H2

Weigh it out

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

Work with 1-Iodo-3-fluoropropane

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-Iodo-2-fluoroethane762-51-660 % similar 1,3-Difluoropropane462-39-550 % similar 1,3-Diiodopropane627-31-650 % similar 1,4-Diiodobutane628-21-750 % similar 1,10-Diiododecane16355-92-347 % similar 1,8-Diiodooctane24772-63-247 % similar 1,5-Diiodopentane628-77-347 % similar 1,6-Diiodohexane629-09-447 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook