Basic information
- CAS
5558-05-4- Standard SMILES
C=C=CCCBr- InChIKey
FRCYODXAVIIGTN-UHFFFAOYSA-N- Molecular formula
- C5H7Br
- Average molar mass
- 147.01 g/mol
- Monoisotopic mass
- 145.97311
Names & identifiers
- Preferred name
- 5-Bromopenta-1,2-diene
- IUPAC
- 5-bromopenta-1,2-diene
Names & synonyms
5-Bromopenta-1,2-diene5558-05-4DTXSID00494829RefChem:302062DTXCID00445639965-331-35-bromo-1,2-pentadiene5-bromo-penta-1,2-dieneSCHEMBL27684046EN300-7465242
Database identifiers
- CAS
5558-05-4- PubChem CID
- 12371208
- DTXSID
DTXSID00494829- EC Number
- 965-331-3
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 60.3
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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