1,4-Dioxane--water (1/1)

HCID 21886435
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Basic information

CAS
16468-05-6
Standard SMILES
C1COCCO1.O
InChIKey
RNHDAKUGFHSZEV-UHFFFAOYSA-N
Molecular formula
C4H10O3
Average molar mass
106.12 g/mol
Monoisotopic mass
106.06299418

Names & identifiers

Preferred name
1,4-Dioxane--water (1/1)
IUPAC
1,4-dioxane;hydrate

Names & synonyms

16468-05-61,4-Dioxane--water (1/1)DTXSID40619453RefChem:220738DTXCID90570207dioxane waterdioxane-waterwater dioxanedioxan waterwater dioxanp-dioxane waterwater p-dioxane
Show more names
di-oxane water4-dioxane waterdioxane H2Odioxan H2OH2O dioxan1,4dioxane waterH2O Dioxanep-dioxane H2O

Database identifiers

CAS
16468-05-6、60469-77-4
PubChem CID
21886435
DTXSID
DTXSID40619453

Properties

Computed structural properties

Topological polar surface area
19.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
0
Heavy atoms
7

Related reactions

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Compound notes

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