6,6-Dimethylfulvene

C₈H₁₀CAS 2175-91-9106.17 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₈H₁₀
Molar mass: 106.17 g/mol
Exact mass: 106.0783 Da
logP: 2.45Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

Hazards

Danger

H226 Flammable liquid and vapor100% of notifiers
H304 May be fatal if swallowed and enters airways100% of notifiers

Aggregated from 68 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P280, P301+P316, P303+P361+P353, P331, P370+P378, P403+P235, P405, P501

Identifiers

CAS number

2175-91-9

SMILES

CC(=C1C=CC=C1)C

InChIKey

WXACXMWYHXOSIX-UHFFFAOYSA-N

InChI

InChI=1S/C8H10/c1-7(2)8-5-3-4-6-8/h3-6H,1-2H3

Weigh it out

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

Names and synonyms

1 names

1,3-Cyclopentadiene, 5-(1-methylethylidene)-

Work with 6,6-Dimethylfulvene

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

Tetramethylethylene563-79-136 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Ethylbenzene100-41-4 P-Xylene106-42-3 M-Xylene108-38-3 1,3,5-Cyclooctatriene1871-52-9 3,6-Di(methyl-d3)benzene-1,2,4,5-d441051-88-1 1,7-Octadiyne871-84-1 O-Xylene95-47-6

Elsewhere

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