Phenyl(1-Pyrrolidinyl)Methanone
[CAS# 3389-54-6]

Identification

• Name: Phenyl(1-Pyrrolidinyl)Methanone
• Synonyms: (phenyl)pyrrolidin-1-ylmethanone; 1-benzoylpyrrolidine; InChI=1/C11H13NO/c13-11(12-8-4-5-9-12)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2
• Molecular Formula: C₁₁H₁₃NO
• Molecular Weight: 175.23
• CAS Registry Number: 3389-54-6
• SMILES: C1CCN(C1)C(=O)C2=CC=CC=C2
• InChI: 1S/C11H13NO/c13-11(12-8-4-5-9-12)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2
• InChIKey: VIQDUCBDZPYNNX-UHFFFAOYSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 303.8±11.0°C at 760 mmHg (Cal.)
• Flash point: 138.0±10.5°C (Cal.)

References

• (1): Hege Karlsen, Per Kolsaker, Christian Rømming and Einar Uggerud. The analogy between C?O and C(CN). Part 2. Structural properties of N,N-dialkylaminobenzamides and the analogously substituted 2-(phenylmethylene)propanedinitriles, J. Chem. Soc., Perkin Trans. 2, 2002, 0, 404.