1-Ethoxy-2,2-difluoroethanol

C₄H₈F₂O₂CAS 148992-43-2126.10 g/mol

Open in Covalent MOL file

Alcohol Alkyl halide Ether

Properties

Molecular formula: C₄H₈F₂O₂
Molar mass: 126.10 g/mol
Exact mass: 126.0492 Da
logP: 0.61Crippen estimate
Polar surface area: 29.5 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 3

Hazards

Warning

H226 Flammable liquid and vapor100% of notifiers
H315 Causes skin irritation35.7% of notifiers
H319 Causes serious eye irritation35.7% of notifiers
H335 May cause respiratory irritation35.7% of notifiers
H411 Toxic to aquatic life with long lasting effects21.4% of notifiers

Aggregated from 14 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P273, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P391, P403+P233, P403+P235, P405, P501

Identifiers

CAS number

148992-43-2

SMILES

CCOC(O)C(F)F

InChIKey

WEEOMNFWRCDRJI-UHFFFAOYSA-N

InChI

InChI=1S/C4H8F2O2/c1-2-8-4(7)3(5)6/h3-4,7H,2H2,1H3

Weigh it out

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

Names and synonyms

4 names

Ethanol, 1-ethoxy-2,2-difluoro-
Difluoroacetaldehyde ethyl hemiacetal
2,2-Difluoroacetaldehyde ethyl hemiacetal
α,α-Difluoroacetaldehyde ethyl hemiacetal

Work with 1-Ethoxy-2,2-difluoroethanol

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

Trifluoroacetaldehyde ethyl hemiacetal433-27-241 % similar Triethyl orthoformate122-51-039 % similar 2,2-Diethoxyethanol621-63-637 % similar 1,1-Diethoxyethane105-57-736 % similar 1,1,3,3-Tetraethoxypropane122-31-636 % similar 3,3-Diethoxy-1-propanol16777-87-034 % similar Dimethylformamide diethylacetal1188-33-633 % similar 1,4-Dioxane-2,3-diol4845-50-533 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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