Product Name

  • Name

    methyl 1-(4-fluorobenzyl)-5-oxo-L-prolinate

  • EINECS
  • CAS No. 59749-17-6
  • Density 1.279g/cm3
  • Solubility
  • Melting Point
  • Formula C13H14FNO3
  • Boiling Point 401.5°Cat760mmHg
  • Molecular Weight 251.28
  • Flash Point 196.6°C
  • Transport Information
  • Appearance
  • Safety Moderately toxic by ingestion. When heated to decomposition it emits toxic vapors of NOx and F.
  • Risk Codes
  • Molecular Structure Molecular Structure of 59749-17-6 (methyl 1-(4-fluorobenzyl)-5-oxo-L-prolinate)
  • Hazard Symbols
  • Synonyms
  • PSA
  • LogP

1-((4-FLUOROPHENYL)METHYL)-5-OXO-l-PROLINE METHYL ESTER Chemical Properties

Molecular Weight: 251.253563 [g/mol]
Molecular Formula: C13H14FNO3
XLogP: 1.5
H-Bond Donor: 0
H-Bond Acceptor: 4
Rotatable Bond Count: 4
Tautomer Count: 2
Exact Mass: 251.095772
MonoIsotopic Mass: 251.095772
Topological Polar Surface Area: 46.6
Heavy Atom Count of 1-((4-FLUOROPHENYL)METHYL)-5-OXO-l-PROLINE METHYL ESTER: 18
Formal Charge: 0
Complexity of 1-((4-FLUOROPHENYL)METHYL)-5-OXO-l-PROLINE METHYL ESTER: 326

1-((4-FLUOROPHENYL)METHYL)-5-OXO-l-PROLINE METHYL ESTER Toxicity Data With Reference

1.   

orl-mus LD :>1200 mg/kg

   FRXXBL    French Demande Patent Document. (Commissioner of Patents and Trademarks, Washington, DC 20231) #2273533 .

1-((4-FLUOROPHENYL)METHYL)-5-OXO-l-PROLINE METHYL ESTER Safety Profile

Moderately toxic by ingestion. When heated to decomposition it emits toxic vapors of NOx and F?.
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