2,2-dimethyl-3-phenyl-5,6-dihydro-1H-pyrazine
Basic information
- CAS
945-35-7- Standard SMILES
CC1(C)NCCN=C1c1ccccc1- InChIKey
YAMDVGFBIWGKAY-UHFFFAOYSA-N- Molecular formula
- C12H16N2
- Average molar mass
- 188.27 g/mol
- Monoisotopic mass
- 188.13134852
Names & identifiers
- Preferred name
- 2,2-dimethyl-3-phenyl-5,6-dihydro-1H-pyrazine
- IUPAC
- 6,6-dimethyl-5-phenyl-2,3-dihydro-1H-pyrazine
Names & synonyms
945-35-72,2-dimethyl-3-phenyl-5,6-dihydro-1H-pyrazineNSC401935DTXSID80322732NSC-4019356,6-dimethyl-5-phenyl-1,2,3,6-tetrahydropyrazine
Database identifiers
- CAS
945-35-7- PubChem CID
- 344819
- DTXSID
DTXSID80322732
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 24.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 224
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…