Basic information
- CAS
3289-43-8- Standard SMILES
CCOc1cc(N)ncn1- InChIKey
UQLUVBGBWSHZDK-UHFFFAOYSA-N- Molecular formula
- C6H9N3O
- Average molar mass
- 139.16 g/mol
Names & identifiers
- Preferred name
- 6-Ethoxypyrimidin-4-amine
- IUPAC
- 6-ethoxypyrimidin-4-amine
- English name
- Pyrimidine, 4-amino-6-ethoxy- (7CI,8CI)
- Molecular formula
- C6H9N3O
- Molecular weight
- 139.16
Names & synonyms
6-ethoxypyrimidin-4-amine3289-43-8F1967-13844-amino-6-ethoxypyrimidine6-ethoxy-4-pyrimidinylamineSCHEMBL10188104SMSSF-0533030AKOS006337983F5420574-Pyrimidinamine, 6-ethoxy-6-ethoxypyrimidin-4-amine - [AC78347]Pyrimidine, 4-amino-6-ethoxy- (7CI,8CI)
Database identifiers
- CAS
3289-43-8
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 61 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 99
Physicochemical properties
- Melting point
- 145.5 · 145.5-146.5 °C(Solv: benzene (71-43-2))
- Boiling point
- 297.6 · 297.6±20.0 °C(Predicted)
- Density
- 1.172 · 1.172±0.06 g/cm3(Predicted)
- pka
- 4.2 · 4.20±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H319
- Precautionary statements
- 305 · P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H319
- Precautionary statements
- P305+P351+P338
Chemistry & industry
Suppliers2 total
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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