6-(dimethylamino)pyrimidine-2,4(1H,3H)-dione
Basic information
- CAS
4805-72-5- Standard SMILES
CN(C)c1cc(=O)[nH]c(=O)[nH]1- InChIKey
YNLGVBOEKLBPKY-UHFFFAOYSA-N- Molecular formula
- C6H9N3O2
- Average molar mass
- 155.15 g/mol
- Monoisotopic mass
- 155.06947654
Names & identifiers
- Preferred name
- 6-(dimethylamino)pyrimidine-2,4(1H,3H)-dione
- IUPAC
- 6-(dimethylamino)-1H-pyrimidine-2,4-dione
- English name
- 6-dimethylamino-1H-pyrimidine-2,4-dione
- Molecular formula
- C6H9N3O2
- Molecular weight
- 155.15
Names & synonyms
4805-72-56-(dimethylamino)pyrimidine-2,4(1H,3H)-dione6-(dimethylamino)-1H-pyrimidine-2,4-dione6-dimethylamino-1H-pyrimidine-2,4-dione6-(DIMETHYLAMINO)-1,2,3,4-TETRAHYDROPYRIMIDINE-2,4-DIONENSC212428N,N-dimethyl-6-amino uracilCHEMBL452881SCHEMBL1362732DTXSID10309637NSC 212428NSC-212428
Show more names
BS-52039DB-129432F774466-(dimethylamino)-2,4(1H,3H)-pyrimidinedione2,4(1H,3H)-Pyrimidinedione, 6-(dimethylamino)-F864317
Database identifiers
- CAS
4805-72-5- PubChem CID
- 309964
- DTXSID
DTXSID10309637- ChEMBL
CHEMBL452881
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 61.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 232
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
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
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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