Basic information
- CAS
887570-68-5- Standard SMILES
COC(CNc1c[nH]c(=O)[nH]c1=O)OC- InChIKey
SJKYHUUYGOJNQX-UHFFFAOYSA-N- Molecular formula
- C8H13N3O4
- Average molar mass
- 215.21 g/mol
- Monoisotopic mass
- 215.0906059
Names & identifiers
- Preferred name
- 5-[(2,2-dimethoxyethyl)amino]pyrimidine-2,4(1H,3H)-dione
- IUPAC
- 5-(2,2-dimethoxyethylamino)-1H-pyrimidine-2,4-dione
- English name
- 5-[(2,2-dimethoxyethyl)amino]pyrimidine-2,4(1H,3H)-dione
- Molecular formula
- C8H13N3O4
- Molecular weight
- 215.20652
Names & synonyms
5-[(2,2-dimethoxyethyl)amino]pyrimidine-2,4(1H,3H)-dione887570-68-55-(2,2-dimethoxyethylamino)-1H-pyrimidine-2,4-dione5-[(2,2-Dimethoxyethyl)amino]-2,4(1H,3H)-pyrimidinedioneDTXSID801199268SBB095098AB-323/250485745-[(2,2-dimethoxyethyl)amino]-1,3-dihydropyrimidine-2,4-dione
Database identifiers
- CAS
887570-68-5- PubChem CID
- 4456244
- DTXSID
DTXSID801199268
Properties
Computed structural properties
- XLogP
- -0.9
- Topological polar surface area
- 88.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 286
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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