6-Bromo-1,4-dioxaspiro[4.5]decane
Basic information
- CAS
1728-15-0- Standard SMILES
BrC1CCCCC12OCCO2- InChIKey
HIZCXYHMIUSAOV-UHFFFAOYSA-N- Molecular formula
- C8H13BrO2
- Average molar mass
- 221.09 g/mol
- Monoisotopic mass
- 220.00989
Overview
See also: 6-Bromo-1,3-dioxaspiro(4.5)decane (annotation moved to).
Names & identifiers
- Preferred name
- 6-Bromo-1,4-dioxaspiro[4.5]decane
- IUPAC
- 6-bromo-1,4-dioxaspiro[4.5]decane
- English name
- 6-BroMo-1,4-dioxaspiro[4.5]decane
- Molecular formula
- C8H13BrO2
- Molecular weight
- 221.09
Names & synonyms
6-bromo-1,4-dioxaspiro[4.5]decane1728-15-01,4-Dioxaspiro[4.5]decane, 6-bromo-DTXSID70403064HIZCXYHMIUSAOV-UHFFFAOYSA-NMFCD00086705AKOS015836054DB-064864CS-04483716-BROMO-1,3-DIOXASPIRO(4.5)DECANE
Database identifiers
- CAS
1728-15-0- PubChem CID
- 4417941
- DTXSID
DTXSID70403064- Nikkaji
- J1.722.329A
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 143
Physicochemical properties
- Boiling point
- 115 · 115-116 °C(Press: 10 Torr)
- Density
- 1.445 g/cm3 · 1.445 g/cm3
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P
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
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P
Suppliers
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Related reactions
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Compound notes
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