2-Methylene-1,3-dioxepane

C6H10O2CAS 69814-56-8114.14 g/mol

Open in Covalent MOL file
OO
AlkeneEther

Properties

Molecular formula
C6H10O2
Molar mass
114.14 g/mol
Exact mass
114.0681 Da
logP
1.28Crippen estimate
Polar surface area
18.5 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
0

Hazards

Danger
Flammable (GHS02)

Aggregated from 42 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P240, P241, P280, P370+P378

Identifiers

CAS number
69814-56-8
SMILES
C=C1OCCCCO1
InChIKey
AVUFZLGLMCACRE-UHFFFAOYSA-N
InChI
InChI=1S/C6H10O2/c1-6-7-4-2-3-5-8-6/h1-5H2

Weigh it out

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

Work with 2-Methylene-1,3-dioxepane

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

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Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,2-Dimethylbut-3-enoic acid10276-09-2 4-Methyl-2-pentenoic acid10321-71-8 Allyl glycidyl ether106-92-3 1,5-Hexadiene-3,4-diol1069-23-4 Hexanedial1072-21-5 Hexane-2,5-dione110-13-4 Beta-Methyl-delta-valerolactone1121-84-2 2-Hexenoic acid1191-04-4

Elsewhere

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