2-Oxa-5-azabicyclo[2.2.1]heptane;hydrobromide
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Basic information
- CAS
547716-11-0- Standard SMILES
Br.C1OC2CNC1C2- InChIKey
HGEANTQLVIFWHO-UHFFFAOYSA-N- Molecular formula
- C5H10BrNO
- Average molar mass
- 180.04 g/mol
- Monoisotopic mass
- 178.99458
Names & identifiers
- Preferred name
- 2-Oxa-5-azabicyclo[2.2.1]heptane;hydrobromide
- IUPAC
- 2-oxa-5-azabicyclo[2.2.1]heptane;hydrobromide
- English name
- (1S,4S)-2-OXA-5-AZABICYCLO[2.2.1]HEPTANE HYDROBROMIDE 98%
- Molecular formula
- C5H9NO
- Molecular weight
- 99.13
Names & synonyms
159909-28-12-oxa-5-azabicyclo[2.2.1]heptane;hydrobromideDTXSID10586244AKOS0051668522-Oxa-5-azabicyclo[2.2.1]heptane--hydrogen bromide (1/1)(1S,4S)-2-Oxa-5-azabicyclo[2.2.1]heptane2-Oxa-5-azabicyclo[2.2.1]heptane, (1S,4S)-(1S,4S)-2-Oxa-5-azabicyclo[2.2.1]heptane - [X14975](1S,4S)-2-OXA-5-AZABICYCLO[2.2.1]HEPTANE HYDROBROMIDE 98%
Database identifiers
- CAS
547716-11-0- PubChem CID
- 16637475
- DTXSID
DTXSID10586244
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 21.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 84.1
Physicochemical properties
- Boiling point
- 153.6 · 153.6±15.0 °C(Predicted)
- Density
- 1.074 · 1.074±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C(protect from light)
- pka
- 9.12 · 9.12±0.20(Predicted)
- Symbol(GHS)
- 5 · GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 315 · H315-H318-H335-H227
- Precautionary statements
- 210 · P210-P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P310-P332+P313-P362-P370+P378-P403+P233-P403+P235-P405-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- Hazard statements
- H315-H318-H335-H227
- Precautionary statements
- P210-P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P310-P332+P313-P362-P370+P378-P403+P233-P403+P235-P405-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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