1,2,3,4-Tetramethylcyclopentadiene

C₉H₁₄CAS 4249-10-9122.21 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₉H₁₄
Molar mass: 122.21 g/mol
Exact mass: 122.1096 Da
logP: 3.06Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

Hazards

Warning

H226 Flammable liquid and vapor100% of notifiers

Aggregated from 46 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

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

Identifiers

CAS number

4249-10-9

SMILES

CC1=C(C(=C(C1)C)C)C

InChIKey

VNPQQEYMXYCAEZ-UHFFFAOYSA-N

InChI

InChI=1S/C9H14/c1-6-5-7(2)9(4)8(6)3/h5H2,1-4H3

Weigh it out

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

Names and synonyms

1 names

1,2,3,4-Tetramethyl-1,3-cyclopentadiene

Work with 1,2,3,4-Tetramethylcyclopentadiene

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

(3Z)-3,4-Dimethyl-3-hexene19550-87-935 % similar

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

Same formula

1,2-Cyclononadiene1123-11-1 (Prop-2-yn-1-yl)cyclohexane17715-00-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook