6-Bromo-3-hydroxyhexanoic acid
Basic information
- CAS
126502-98-5- Standard SMILES
O=C(O)CC(O)CCCBr- InChIKey
PRMNZQRHYSTJDR-UHFFFAOYSA-N- Molecular formula
- C6H11BrO3
- Average molar mass
- 211.05 g/mol
- Monoisotopic mass
- 209.98916
Names & identifiers
- Preferred name
- 6-Bromo-3-hydroxyhexanoic acid
- IUPAC
- 6-bromo-3-hydroxyhexanoic acid
Names & synonyms
6-BROMO-3-HYDROXYHEXANOIC ACID126502-98-5DTXSID10562427RefChem:307497DTXCID205132033-hydroxy-6-bromohexanoic acidSCHEMBL666360
Database identifiers
- CAS
126502-98-5- PubChem CID
- 14637745
- DTXSID
DTXSID10562427- Nikkaji
- J316.280J
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 105
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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