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1,2:8,9-Diepoxynonane

HCID 32683
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Basic information

CAS
24829-11-6
Standard SMILES
C(CCC1CO1)CCC1CO1
InChIKey
NWBKYDBUDMLQQN-UHFFFAOYSA-N
Molecular formula
C9H16O2
Average molar mass
156.22 g/mol
Monoisotopic mass
156.11502975

Names & identifiers

Preferred name
1,2:8,9-Diepoxynonane
IUPAC
2-[5-(oxiran-2-yl)pentyl]oxirane
English name
2,2'-(1,5-Pentanediyl)bisoxirane
Molecular formula
C9H16O2
Molecular weight
156.22

Names & synonyms

1,2:8,9-Diepoxynonane24829-11-62-[5-(oxiran-2-yl)pentyl]oxirane1,5-Di(oxiran-2-yl)pentaneOxirane, 2,2'-(1,5-pentanediyl)bis-BRN 0106044NONANE, 1,2:8,9-DIEPOXY-4-19-00-00138 (Beilstein Handbook Reference)SCHEMBL4539533DTXSID709477362,2'-(1,5-Pentanediyl)bisoxirane2,2'-(Pentane-1,5-diyl)bis(oxirane)

Database identifiers

CAS
24829-11-6
PubChem CID
32683
DTXSID
DTXSID70947736
Nikkaji
J34.587C

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
25.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
6
Heavy atoms
11
Formal charge
0
Complexity
111

Physicochemical properties

Boiling point
220.47 °C · 220.47°C (rough estimate)
Density
0.9188 · 0.9188 (rough estimate)
refractive index
1.435 · 1.4350 (estimate)

Related reactions

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Compound notes

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