Basic information
- CAS
14225-98-0- Standard SMILES
BrCc1ncnc2nc[nH]c12- InChIKey
KJRSLPCFTVMQGY-UHFFFAOYSA-N- Molecular formula
- C6H5BrN4
- Average molar mass
- 213.03 g/mol
- Monoisotopic mass
- 211.96976
Names & identifiers
- Preferred name
- 6-(Bromomethyl)-9H-purine
- IUPAC
- 6-(bromomethyl)-7H-purine
- English name
- 6-(bromomethyl)-9H-purine
- Molecular weight
- 0
Names & synonyms
6-(Bromomethyl)-9H-purine14225-98-06-BmpuDTXSID00161988RefChem:104076DTXCID10844796-(bromomethyl)-7H-purine1H-Purine, 6-(bromomethyl)-
Database identifiers
- CAS
14225-98-0- PubChem CID
- 5488233
- DTXSID
DTXSID00161988- Nikkaji
- J641.944E
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 54.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 143
Chemistry & industry
Suppliers1 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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