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Basic information
- CAS
7252-38-2- Standard SMILES
Cn1c(=O)c2[nH]c(CCCc3nc4c(c(=O)n(C)c(=O)n4C)n3C)nc2n(C)c1=O- InChIKey
UGLNWWGMHZEWGJ-UHFFFAOYSA-N- Molecular formula
- C18H22N8O4
- Average molar mass
- 414.426 g/mol
- Monoisotopic mass
- 414.17640118
Names & identifiers
- Preferred name
- 8-[3-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1h-purin-8-yl)propyl]-1,3,7-trimethyl-3,7-dihydro-1h-purine-2,6-dione
- IUPAC
- 8-[3-(1,3-Dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)propyl]-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
- English name
- 8-[3-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)propyl]-1,3,7-trimethyl-pur ine-2,6-dione
- Molecular formula
- C18H22N8O4
- Molecular weight
- 414.42
Names & synonyms
8-[3-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)propyl]-1,3,7-trimethyl-pur ine-2,6-dione1H-Purine-2,6-dione, 3,7-dihydro-1,3,7-trimethyl-8-[3-(2,3,6,9-tetrahydro-1,3-dimethyl-2,6-dioxo-1H-purin-8-yl)propyl]-
Database identifiers
- CAS
7252-38-2- PubChem CID
- 229727
- DTXSID
DTXSID70281960- ChEMBL
CHEMBL4583111
Properties
Physicochemical properties
- Boiling point
- 755.3 · 755.3±70.0 °C(Predicted)
- Density
- 1.58 · 1.58±0.1 g/cm3(Predicted)
- pka
- 8.97 · 8.97±0.70(Predicted)
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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