Basic information
- CAS
54815-24-6- Standard SMILES
O=C1OCCC1CCBr- InChIKey
IGLXGNWTGHUHHI-UHFFFAOYSA-N- Molecular formula
- C6H9BrO2
- Average molar mass
- 193.04 g/mol
- Monoisotopic mass
- 191.97859
Names & identifiers
- Preferred name
- 3-(2-Bromoethyl)dihydrofuran-2(3H)-one
- IUPAC
- 3-(2-bromoethyl)oxolan-2-one
- English name
- 3-(2-Bromoethyl)-4,5-dihydro-2(3H)-furanone
- Molecular weight
- 0
Names & synonyms
81478-17-33-(2-bromoethyl)dihydrofuran-2(3H)-oneRefChem:490717893-371-03-(2-bromoethyl)oxolan-2-one54815-24-6MFCD189714472(3H)-Furanone, 3-(2-bromoethyl)dihydro-3-(2-Bromoethyl)dihydro-2(3H)-furanone3-(2-Bromoethyl)-4,5-dihydro-2(3H)-furanoneSCHEMBL2227801DTXSID30335054
Show more names
IGLXGNWTGHUHHI-UHFFFAOYSA-NGDA47817AKOS0267277533-(2-bromoethyl)tetrahydrofuran-2-oneDB-203612DB-3144403-(2-bromoethyl) dihydro-2 (3h)-furanone3-(2-Bromoethyl)dihydro-2(3H)-furanone #
Database identifiers
- CAS
54815-24-6、81478-17-3- PubChem CID
- 522752
- DTXSID
DTXSID30335054- EC Number
- 893-371-0
- Nikkaji
- J103.958J
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 114
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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