1,2,3,4-tetraphenylnaphthalene

• ChemBase ID: 112521
• Molecular Formular: C34H24
• Molecular Mass: 432.55436
• Monoisotopic Mass: 432.18780077
• SMILES: c1ccc(cc1)c1c(c2ccccc2)c(c2ccccc2)c(c2ccccc2)c2ccccc12
• Canonical SMILES: c1ccc(cc1)c1c(c2ccccc2)c2ccccc2c(c1c1ccccc1)c1ccccc1
• InChI: InChI=1S/C34H24/c1-5-15-25(16-6-1)31-29-23-13-14-24-30(29)32(26-17-7-2-8-18-26)34(28-21-11-4-12-22-28)33(31)27-19-9-3-10-20-27/h1-24H
• InChIKey: UCTTYTFENYGAPP-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1,2,3,4-tetraphenylnaphthalene
• IUPAC Traditional name: 1,2,3,4-tetraphenylnaphthalene
• Synonyms: 1,2,3,4-TETRAPHENYL NAPHTHALENE; 1,2,3,4-Tetraphenylnaphthalene; 1,2,3,4-Tetraphenylnaphthalene; 1,2,3,4-四苯基萘

Database IDs

• CAS Number: 751-38-2
• MDL Number: MFCD00046418
• PubChem SID: 162097342; 24848972
• PubChem CID: 69783
• Chemspider ID: 62982
• Wikipedia Title: 1,2,3,4-Tetraphenylnaphthalene

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 9.551624
• LogD (pH = 7.4): 9.551624
• Log P: 9.551624
• Molar Refractivity: 143.053 cm^3
• Polarizability: 62.716225 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Melting Point: 199-201 °C; 199-201 °C(lit.)

Safety Information

• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 36/37/38; R36/37/38
• Safety Statements: 26-36; S26 S36
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305 + P351 + P338
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves

Product Information

• Purity: 97%
• Linear Formula: C10H4(C6H5)4

DETAILS

MP Biomedicals - 05224510

MP Biomedicals Rare Chemical collection

Sigma Aldrich - 149799

Frequently Asked Questions
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Packaging
1 g in glass bottle