[(ethenyloxy)methyl]benzene

• ChemBase ID: 235780
• Molecular Formular: C9H10O
• Molecular Mass: 134.1751
• Monoisotopic Mass: 134.07316494
• SMILES: C(=C)OCc1ccccc1
• Canonical SMILES: C=COCc1ccccc1
• InChI: InChI=1S/C9H10O/c1-2-10-8-9-6-4-3-5-7-9/h2-7H,1,8H2
• InChIKey: AZDCYKCDXXPQIK-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: [(ethenyloxy)methyl]benzene
• IUPAC Traditional name: [(ethenyloxy)methyl]benzene
• Synonyms: [(ethenyloxy)methyl]benzene; (vinyloxymethyl)benzene

Database IDs

• MDL Number: MFCD12547209
• PubChem SID: 164291690
• PubChem CID: 11116115

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 2.353697
• LogD (pH = 7.4): 2.353697
• Log P: 2.353697
• Molar Refractivity: 41.3173 cm^3
• Polarizability: 16.329235 Å^3
• Polar Surface Area: 9.23 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 2.145

Product Information

• Purity: 95%; 98%