2-(5-Bromopentyl)oxolane
Basic information
- CAS
175913-57-2- Standard SMILES
BrCCCCCC1CCCO1- InChIKey
SQQSDJQBRWFOME-UHFFFAOYSA-N- Molecular formula
- C9H17BrO
- Average molar mass
- 221.13 g/mol
- Monoisotopic mass
- 220.04628
Names & identifiers
- Preferred name
- 2-(5-Bromopentyl)oxolane
- IUPAC
- 2-(5-bromopentyl)oxolane
Names & synonyms
2-(5-bromopentyl)oxolane2-(5-Bromopentyl)tetrahydrofuran175913-57-2AKOS014499423CS-0266156EN300-674428
Database identifiers
- CAS
175913-57-2- PubChem CID
- 10489151
- EC Number
- 182-780-3
- Nikkaji
- J711.412E
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 95.6
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, 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 CategoriesSkin Irrit. 2 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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