1,2-dicyclopropyl-1-methylcyclopropane

• ChemBase ID: 129680
• Molecular Formular: C10H16
• Molecular Mass: 136.23404
• Monoisotopic Mass: 136.12520051
• SMILES: CC1(C2CC2)C(C2CC2)C1
• Canonical SMILES: CC1(CC1C1CC1)C1CC1
• InChI: InChI=1S/C10H16/c1-10(8-4-5-8)6-9(10)7-2-3-7/h7-9H,2-6H2,1H3
• InChIKey: GTKAAVZEFUFXDD-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1,2-dicyclopropyl-1-methylcyclopropane
• IUPAC Traditional name: syntin
• Synonyms: 1-Methyl-1,2-dicyclopropylcyclopropane; Sintin; Synthin; Tsycklin; Syntin

Database IDs

• CAS Number: 93223-46-2
• PubChem SID: 162223969
• PubChem CID: 519050
• Wikipedia Title: Syntin

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 2.743515
• LogD (pH = 7.4): 2.743515
• Log P: 2.743515
• Molar Refractivity: 42.0701 cm^3
• Polarizability: 16.98449 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Boiling Point: 158°C
• Density: 0.851 g/mL