1,4-diethenylbenzene ethenylbenzene phenyl acetate

• ChemBase ID: 137841
• Molecular Formular: C26H26O2
• Molecular Mass: 370.48344
• Monoisotopic Mass: 370.19328007
• SMILES: CC(=O)Oc1ccccc1.C=Cc1ccccc1.C=Cc1ccc(cc1)C=C
• Canonical SMILES: CC(=O)Oc1ccccc1.C=Cc1ccccc1.C=Cc1ccc(cc1)C=C
• InChI: InChI=1S/C10H10.C8H8O2.C8H8/c1-3-9-5-7-10(4-2)8-6-9;1-7(9)10-8-5-3-2-4-6-8;1-2-8-6-4-3-5-7-8/h3-8H,1-2H2;2-6H,1H3;2-7H,1H2
• InChIKey: GICRPNUVBSBZOP-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1,4-diethenylbenzene ethenylbenzene phenyl acetate
• IUPAC Traditional name: divinylbenzene styrene phenyl acetate
• Synonyms: Acetyloxypolystyrene; 乙酰氧基聚苯乙烯

Database IDs

• MDL Number: MFCD03454271
• PubChem SID: 162232102; 24874690
• PubChem CID: 16213855

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 1.5805068
• LogD (pH = 7.4): 1.5805068
• Log P: 1.5805068
• Molar Refractivity: 37.1904 cm^3
• Polarizability: 14.751974 Å^3
• Polar Surface Area: 26.3 Å^2
• Rotatable Bonds: 5
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• German water hazard class: 3
• Personal Protective Equipment: Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter

Product Information

• Particle Size: 100-200 mesh
• Extent of Labeling: 0.5-1.5 mmol/g loading
• Crosslinking: 1 % cross-linked