N,N-Dibenzyl-2-chloroacetamide
Basic information
- CAS
2567-51-3- Standard SMILES
O=C(CCl)N(Cc1ccccc1)Cc1ccccc1- InChIKey
OVWIRORWDCWBCF-UHFFFAOYSA-N- Molecular formula
- C16H16ClNO
- Average molar mass
- 273.75 g/mol
- Monoisotopic mass
- 273.0920418
Names & identifiers
- Preferred name
- N,N-Dibenzyl-2-chloroacetamide
- IUPAC
- N,N-dibenzyl-2-chloroacetamide
- English name
- N,N-Dibenzyl-2-chloro-acetamide
- Molecular formula
- C16H16ClNO
- Molecular weight
- 273.76
Names & synonyms
N,N-DIBENZYL-2-CHLOROACETAMIDE2567-51-3N,N-DIBENZYL-2-CHLORO-ACETAMIDENSC2374N,N-DibenzylchloroacetamideACETAMIDE,2-CHLORO-N,N-BIS(PHENYLMETHYL)-chloro-acetic acid dibenzylamideSCHEMBL5451636SCHEMBL9370137DTXSID90277446OVWIRORWDCWBCF-UHFFFAOYSA-NNSC 2374
Show more names
NSC-2374STL284198AKOS001042951HS-4236DS-006259Acetamide, 2-chloro-N,N-bis(phenylmethyl)-
Database identifiers
- CAS
2567-51-3- PubChem CID
- 220099
- DTXSID
DTXSID90277446- Nikkaji
- J3.336.365F
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 250
Experimental & physicochemical properties
SpringerMaterials PropertiesOptical coefficient
Physicochemical properties
- Melting point
- 97 · 97-100 °C(Solv: ethanol (64-17-5))
- Boiling point
- 165 · 165-166 °C(Press: 0.05 Torr)
- Density
- 1.181 · 1.181±0.06 g/cm3(Predicted)
- pka
- -1.01 · -1.01±0.70(Predicted)
Chemistry & industry
Applications
UsesN,N-Dibenzyl-2-chloroacetamide (cas# 2567-51-3) is a useful reactant for the diastereo-/chemoselective preparation of vinyl silanes/silyl-substituted alpha, beta-unsaturated amides by Pd-catalyzed olefination.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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