(trimethoxymethyl)cyclopropane

• ChemBase ID: 285464
• Molecular Formular: C7H14O3
• Molecular Mass: 146.18426
• Monoisotopic Mass: 146.09429431
• SMILES: C(C1CC1)(OC)(OC)OC
• Canonical SMILES: COC(C1CC1)(OC)OC
• InChI: InChI=1S/C7H14O3/c1-8-7(9-2,10-3)6-4-5-6/h6H,4-5H2,1-3H3
• InChIKey: XVTIKAUHDBNMAN-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (trimethoxymethyl)cyclopropane
• IUPAC Traditional name: (trimethoxymethyl)cyclopropane
• Synonyms: (trimethoxymethyl)cyclopropane

Database IDs

• MDL Number: MFCD06797735
• PubChem SID: 180670995
• PubChem CID: 14860741

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): 1.4362203
• LogD (pH = 7.4): 1.4362203
• Log P: 1.4362203
• Molar Refractivity: 37.685 cm^3
• Polarizability: 15.006049 Å^3
• Polar Surface Area: 27.69 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.273

Product Information

• Purity: 95%