Deuterated thf

C₄D₈OCAS 1693-74-980.16 g/mol

Open in Covalent MOL file

Ether

Properties

Molecular formula: C₄D₈O
Molar mass: 80.16 g/mol
Exact mass: 80.1077 Da
Density: 0.985 g/mL (at 25 °C)
Melting point: −105.6 °C
Boiling point: 65.4 °C
logP: 0.80Crippen estimate
Polar surface area: 9.2 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Hazards

Danger

H225 Highly Flammable liquid and vapor94.2% of notifiers
H315 Causes skin irritation75% of notifiers
H319 Causes serious eye irritation92.3% of notifiers
H335 May cause respiratory irritation26.9% of notifiers
H351 Suspected of causing cancer75% of notifiers

Aggregated from 52 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P318, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501

Identifiers

CAS number

1693-74-9

SMILES

[2H]C1([2H])OC([2H])([2H])C([2H])([2H])C1([2H])[2H]

InChIKey

WYURNTSHIVDZCO-SVYQBANQSA-N

InChI

InChI=1S/C4H8O/c1-2-4-5-3-1/h1-4H2/i1D2,2D2,3D2,4D2

Weigh it out

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

Names and synonyms

9 names

Furan-2,3,4,5-d4, tetrahydro-d4-
Furan-d4, tetrahydro-d4-
Tetrahydro-d4furan-2,3,4,5-d4
Tetrahydrofuran-d8
THF-d8
Perdeuterotetrahydrofuran
d8-THF
2,2,3,3,4,4,5,5-Octadeuteriooxolane
(2H4)Tetrahydro(2H4)furan

Work with Deuterated thf

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 Boiling point under vacuumAt any pressure, from its normal boiling point 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.

Tetrahydrofuran109-99-9Unlabelled Tetrachlorobis(tetrahydrofuran)zirconium21959-01-3Salt, unlabelled

Similar compounds

1,4-Dioxane-D817647-74-456 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1,2-Epoxybutane106-88-7 Ethyl vinyl ether109-92-2 2-Methoxypropene116-11-0 Butyraldehyde123-72-8 cis-2,3-Epoxybutane1758-33-4 trans-2,3-Dimethyloxirane21490-63-1 Poly(ethyl vinyl ether)25104-37-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia