cyclopropa-1,1(3),2-triene

• ChemBase ID: 126819
• Molecular Formular: C3
• Molecular Mass: 36.0321
• Monoisotopic Mass: 36
• SMILES: C1=C=C=1
• Canonical SMILES: C1=C=C=1
• InChI: InChI=1S/C3/c1-2-3-1
• InChIKey: YFIWEVIZVZPDMO-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: cyclopropa-1,1(3),2-triene
• IUPAC Traditional name: cyclopropatriene
• Synonyms: Cyclopropatriene

Database IDs

• PubChem SID: 162221146
• PubChem CID: 57449547
• Wikipedia Title: Cyclopropatriene

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 0.710766
• LogD (pH = 7.4): 0.710766
• Log P: 0.710766
• Molar Refractivity: 12.8451 cm^3
• Polarizability: 3.880898 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true