(E)-1-Chloro-2,3,3,3-tetrafluoropropene

C₃HClF₄CAS 111512-52-8148.48 g/mol

Open in Covalent MOL file

Alkene Alkyl halide Vinyl halide

Properties

Molecular formula: C₃HClF₄
Molar mass: 148.48 g/mol
Exact mass: 147.9703 Da
logP: 2.60Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0
Double bonds: EE/Z, in SMILES order

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

111512-52-8

SMILES

C(=C(\C(F)(F)F)/F)\Cl

InChIKey

GDPWRLVSJWKGPJ-OWOJBTEDSA-N

InChI

InChI=1S/C3HClF4/c4-1-2(5)3(6,7)8/h1H/b2-1+

Weigh it out

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

Names and synonyms

4 names

(E)-1-Chloro-2,3,3,3-tetrafluoroprop-1-ene
(1E)-1-Chloro-2,3,3,3-tetrafluoroprop-1-ene
E-1-Chloro-2,3,3,3-tetrafluoropropene
(E)-1-Chloro-2,3,3,3-tetrafluoro-prop-1-ene

Work with (E)-1-Chloro-2,3,3,3-tetrafluoropropene

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

(Z)-1-Chloro-2,3,3,3-tetrafluoropropene111512-60-8Diastereomer

Similar compounds

1,2-Dichloro-3,3,3-trifluoroprop-1-ene431-27-648 % similar 1,1-Difluoro-2-chloroethylene359-10-438 % similar 1-Fluoro-1,2-dichloroethylene430-58-035 % similar Perfluoro-2-butene360-89-433 % similar 1-Bromo-2-(trifluoromethyl)-3,3,3-trifluoroprop-1-ene382-15-033 % similar 2-Chloro-1,1,3,3,3-pentafluoropropene2804-50-432 % similar 2,3-Dichloro-1,1,1,4,4,4-hexafluoro-2-butene303-04-832 % similar 1,2-Dibromo-3,3,3-trifluoro-1-propene431-22-131 % similar

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

Elsewhere

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