Completing data — usually done within a minute
Basic information
- CAS
56598-88-0- Standard SMILES
Brc1cccc(-c2ccncn2)c1- InChIKey
ZCYZHYXWAFEARM-UHFFFAOYSA-N- Molecular formula
- C10H7BrN2
- Average molar mass
- 235.08 g/mol
- Monoisotopic mass
- 233.97926
Names & identifiers
- Preferred name
- 4-(3-Bromophenyl)pyrimidine
- IUPAC
- 4-(3-bromophenyl)pyrimidine
Names & synonyms
4-(3-bromophenyl)pyrimidine56598-88-03-(4-bromophenyl)pyrimidineSCHEMBL7672405ZCYZHYXWAFEARM-UHFFFAOYSA-NAKOS0235670594-(3-BROMO-PHENYL)-PYRIMIDINECS-45025DB-379639
Database identifiers
- CAS
56598-88-0- PubChem CID
- 3301512
- EC Number
- 104-776-2
Properties
Computed structural propertiesFilling in
- XLogP
- 2.6
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 163
Chemistry & industry
Suppliers2 total
康姆芘法思（上海）生物科技有限公司021-65232103 17602124823 · [email protected]
康姆芘法思（上海）生物科技有限公司021-65232103 17602124823 · [email protected]
Related reactions
1 records
Compound notes
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