1-Bromo-3,3,3-trifluoroprop-1-ene

C₃H₂BrF₃CAS 149597-47-7174.95 g/mol

Open in Covalent MOL file

Alkene Alkyl halide Vinyl halide

Properties

Molecular formula: C₃H₂BrF₃
Molar mass: 174.95 g/mol
Exact mass: 173.9292 Da
logP: 2.46Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0
Double bonds: EE/Z, in SMILES order

Identifiers

CAS number

149597-47-7

SMILES

C(=C/Br)\C(F)(F)F

InChIKey

XRZHWZVROHBBAM-OWOJBTEDSA-N

InChI

InChI=1S/C3H2BrF3/c4-2-1-3(5,6)7/h1-2H/b2-1+

Weigh it out

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

Work with 1-Bromo-3,3,3-trifluoroprop-1-ene

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

1,3,3,3-Tetrafluoropropene1645-83-642 % similar 1,1,1-Trifluoro-2-butene406-39-342 % similar 4,4,4-Trifluoro-2-butenenitrile406-86-035 % similar 4,4,4-Trifluoro-2-buten-1-ol674-53-335 % similar 1,2-Dibromoethene540-49-833 % similar 3,3,3-Trifluoropropene677-21-430 % similar

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

Same formula

2-Bromo-3,3,3-trifluoro-1-propene1514-82-5

Elsewhere

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