Basic information
- CAS
639855-54-2- Standard SMILES
COCc1cn2cccnc2n1- InChIKey
FHFRZAZBLVBCQS-UHFFFAOYSA-N- Molecular formula
- C8H9N3O
- Average molar mass
- 163.18 g/mol
- Monoisotopic mass
- 163.07456192
Names & identifiers
- Preferred name
- 2-(Methoxymethyl)imidazo[1,2-A]pyrimidine
- IUPAC
- 2-(methoxymethyl)imidazo[1,2-a]pyrimidine
- English name
- Imidazo[1,2-a]pyrimidine, 2-(methoxymethyl)- (9CI)
- Molecular formula
- C8H9N3O
- Molecular weight
- 163.18
Names & synonyms
2-(METHOXYMETHYL)IMIDAZO[1,2-A]PYRIMIDINE639855-54-2DB-276755Imidazo[1,2-a]pyrimidine, 2-(methoxymethyl)-Imidazo[1,2-a]pyrimidine, 2-(methoxymethyl)- (9CI)
Database identifiers
- CAS
639855-54-2- PubChem CID
- 11400957
- Nikkaji
- J1.974.698D
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 39.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 153
Physicochemical properties
- Melting point
- 63 · 63-65 °C
- Density
- 1.25 · 1.25±0.1 g/cm3(Predicted)
- pka
- 5.04 · 5.04±0.30(Predicted)
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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