Basic information
- Standard SMILES
O=c1[nH]c(Cl)c(Br)c(=O)[nH]1- InChIKey
BHFJCCPUFJLYBF-UHFFFAOYSA-N- Molecular formula
- C4H2BrClN2O2
- Average molar mass
- 225.43 g/mol
Names & identifiers
- Preferred name
- 5-Bromo-6-chloropyrimidine-2,4-diol
- IUPAC
- 5-bromo-6-chloro-1H-pyrimidine-2,4-dione
Names & synonyms
21428-23-95-Bromo-6-chloropyrimidine-2,4-diol5-bromo-6-chloropyrimidine-2,4(1H,3H)-dione5-bromo-6-chloro-1,2,3,4-tetrahydropyrimidine-2,4-dione5-bromo-6-chloro-1H-pyrimidine-2,4-dioneSCHEMBL4831979SCHEMBL10745526STK763927AKOS001738201SB59142DB-206958ST4059739
Show more names
G617025-Bromo-6-chloro-2,4(1H,3H)-pyrimidinedione5-bromo-6-chloropyrimidine-2,4(1h, 3h)-dione5-Bromo-6-chloro-2,4(1H,3H)-pyrimidinedione #SR-010005314385-bromo-6-chloro-1,3-dihydropyrimidine-2,4-dionePyrimidine-2,4(1H,3H)-dione, 5-bromo-6-chloro-SR-01000531438-1
Database identifiers
- PubChem CID
- 589834
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 237
Related reactions
2 records
Compound notes
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