Basic information
- CAS
619331-53-2- Standard SMILES
C[C@@H]1CNCCN1C(=O)c1ccccc1- InChIKey
SXAIXGMQDJUBDK-SNVBAGLBSA-N- Molecular formula
- C12H16N2O
- Average molar mass
- 204.27 g/mol
Names & identifiers
- Preferred name
- (R)-2-Methyl-1-benzoylpiperazine
- IUPAC
- [(2R)-2-methylpiperazin-1-yl]-phenylmethanone
- English name
- (R)-2-Methyl-1-benzoylpiperazine
- Molecular formula
- C12H16N2O
- Molecular weight
- 204.27
Names & synonyms
(R)-2-Methyl-1-benzoylpiperazine619331-53-2(R)-(2-methylpiperazin-1-yl)(phenyl)methanone[(2R)-2-methylpiperazin-1-yl]-phenylmethanoneSCHEMBL1763575AKOS017558671((R)-2-METHYLPIPERAZIN-1-YL)(PHENYL)METHANONEMethanone, [(2R)-2-methyl-1-piperazinyl]phenyl-
Database identifiers
- CAS
619331-53-2
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 224
Physicochemical properties
- Boiling point
- 345.3 · 345.3±35.0 °C(Predicted)
- Density
- 1.071 · 1.071±0.06 g/cm3(Predicted)
- pka
- 8.52 · 8.52±0.40(Predicted)
Chemistry & industry
Suppliers2 total
深圳爱拓化学有限公司0755- 33239182 · [email protected]
SINOVA[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…