1,2-Ethanediol,1,1,2-triphenyl-,2-acetate,(2R)-

• CAS: 95061-47-5
• Catalog Number: ACM95061475
• Category: Other Products
• Molecular Weight: 332.39
• Molecular Formula: C₂₂H₂₀O₃
• Synonyms: 376507_ALDRICH, ZINC00389842, ST5307668, (R)-()-1,1,2-Triphenyl-1,2-ethanediol 2-acetate, 95061-47-5
• IUPAC Name: [(1R)-2-hydroxy-1,2,2-tri(phenyl)ethyl] acetate
• Canonical SMILES: CC(=O)OC(C1=CC=CC=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O
• InChI Key: GXLZCXZLVDUDHP-OAQYLSRUSA-N
• Boiling Point: 487.6ºC at 760mmHg
• Melting Point: 237-240ºC(lit.)
• Flash Point: 197.6ºC
• Density: 1.18g/cm³
• Appearance: white to light yellow crystal powder
• Exact Mass: 332.14100
• H-Bond Acceptor: 3
• H-Bond Donor: 1
• Safety Description: S24/25

Custom Q&A

What is the molecular formula of 1,1,2-triphenyl-1,2-ethanediol 2-acetate?

The molecular formula is C22H20O3.

What is the molecular weight of 1,1,2-triphenyl-1,2-ethanediol 2-acetate?

The molecular weight is 332.4 g/mol.

What is the IUPAC name of 1,1,2-triphenyl-1,2-ethanediol 2-acetate?

The IUPAC name is [(1R)-2-hydroxy-1,2,2-triphenylethyl] acetate.

What is the InChI of 1,1,2-triphenyl-1,2-ethanediol 2-acetate?

The InChI is InChI=1S/C22H20O3/c1-17(23)25-21(18-11-5-2-6-12-18)22(24,19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-16,21,24H,1H3/t21-/m1/s1.

What is the InChIKey of 1,1,2-triphenyl-1,2-ethanediol 2-acetate?

The InChIKey is GXLZCXZLVDUDHP-OAQYLSRUSA-N.

What is the canonical SMILES of 1,1,2-triphenyl-1,2-ethanediol 2-acetate?

The canonical SMILES is CC(=O)OC(C1=CC=CC=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O.

What is the isomeric SMILES of 1,1,2-triphenyl-1,2-ethanediol 2-acetate?

The isomeric SMILES is CC(=O)O[C@H](C1=CC=CC=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O.

What is the CAS number of 1,1,2-triphenyl-1,2-ethanediol 2-acetate?

The CAS number is 95061-47-5.

What is the XLogP3-AA value of 1,1,2-triphenyl-1,2-ethanediol 2-acetate?

The XLogP3-AA value is 4.

Is 1,1,2-triphenyl-1,2-ethanediol 2-acetate a canonicalized compound?

Yes, it is a canonicalized compound according to PubChem.