Cyclobutene

C₄H₆CAS 822-35-554.09 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₄H₆
Molar mass: 54.09 g/mol
Exact mass: 54.0470 Da
logP: 1.34Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

Hazards

Danger

H224 Extremely flammable liquid and vapor100% of notifiers
H341 Suspected of causing genetic defects100% of notifiers
H351 Suspected of causing cancer100% of notifiers
H373 May causes damage to organs through prolonged or repeated exposure100% of notifiers

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

Precautionary statements

P203, P210, P233, P240, P241, P242, P243, P260, P280, P303+P361+P353, P318, P319, P370+P378, P403+P235, P405, P501

Identifiers

CAS number

822-35-5

SMILES

C1CC=C1

InChIKey

CFBGXYDUODCMNS-UHFFFAOYSA-N

InChI

InChI=1S/C4H6/c1-2-4-3-1/h1-2H,3-4H2

Weigh it out

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

Names and synonyms

2 names

1-Cyclobutene
Cyclobut-1-ene

Reactions

Cyclobuteneproduct

Work with Cyclobutene

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

1,5-Cyclooctadiene111-78-4100 % similar 1,5-Cyclooctadiene1552-12-1100 % similar 1,5,9-Cyclododecatriene4904-61-4100 % similar Trans,trans,trans-1,5,9-Cyclododecatriene676-22-2100 % similar Cyclododecatriene706-31-0100 % similar Bis(cyclooctadiene)nickel(0)1295-35-867 % similar Cyclohexene110-83-856 % similar Cyclopentene142-29-056 % similar

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

Same formula

Butadiene106-99-0 1-Butyne107-00-6 Bicyclobutane157-33-5 1-Methylcyclopropene3100-04-7 2-Butyne503-17-3 1,2-Butadiene590-19-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook