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2-Ethyl-1,3-dioxolane

HCID 17381
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
2568-96-9
Standard SMILES
CCC1OCCO1
InChIKey
WEBRDDDJKLAXTO-UHFFFAOYSA-N
Molecular formula
C5H10O2
Average molar mass
102.13 g/mol
Monoisotopic mass
102.06807956

Names & identifiers

Preferred name
2-Ethyl-1,3-dioxolane
IUPAC
2-ethyl-1,3-dioxolane
English name
2-ethyl-1,3-dioxolane
Molecular formula
C5H10O2
Molecular weight
102.13

Names & synonyms

2-ETHYL-1,3-DIOXOLANE2568-96-91,3-Dioxolane, 2-ethyl-EINECS 219-910-6Propanal, cyclic 1,2-ethanediyl acetalDTXSID80180374RefChem:86856DTXCID90102865219-910-6WEBRDDDJKLAXTO-UHFFFAOYSA-NMFCD007925142-ethyl dioxolane
Show more names
Propanal ethylene acetal
2-ethyl-1,3-dioxolan2-Ethyldioxolane, 97%SCHEMBL26403SCHEMBL26404SCHEMBL359438SCHEMBL1937846SCHEMBL8117469AKOS006275602

Database identifiers

CAS
2568-96-9
PubChem CID
17381
DTXSID
DTXSID80180374
EC Number
219-910-6
Nikkaji
J121.080G

Properties

Computed structural propertiesFilling in

XLogP
0.8
Topological polar surface area
18.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
7
Formal charge
0
Complexity
48

Physicochemical properties

Boiling point
106 °C · 106 °C
Density
0.976 g/cm3 · 0.976 g/cm3
LogP
0.592 · 0.592 (est)
RIDADR
3271 · 3271
HazardClass
3.1 · 3.1
PackingGroup
II

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

ridadr
3271
hazard_class
3.1
packing_group
II

Chemistry & industry

Applications

Uses2-Ethyldioxolane is a chemical found in volatile oil fruit of Cinnamomun camphora.

Upstream & downstream products

Upstream raw materials

Pentanal ethylene acetalOCTYL FORMATEHEXYL FORMATE2-HEXYL-1,3-DIOXOLANEButyl formateEthylene1,3-Dioxolane

Related reactions

1 records
New reaction record
HRID 1649105 reaction equation
HRID 1649105As reactantuspto-grants-1983_11

Compound notes

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