Basic information
- CAS
5663-29-6- Standard SMILES
CCCCCC1OCCCO1- InChIKey
SMUIAOJZCSQUSN-UHFFFAOYSA-N- Molecular formula
- C9H18O2
- Average molar mass
- 158.24 g/mol
- Monoisotopic mass
- 158.13067981
Names & identifiers
- Preferred name
- 1,3-Dioxane, 2-pentyl-
- IUPAC
- 2-pentyl-1,3-dioxane
- English name
- 2-pentyl-1,3-dioxane
- Molecular formula
- C9H18O2
- Molecular weight
- 158.23802
Names & synonyms
2-Pentyl-1,3-dioxane1,3-Dioxane, 2-pentyl-EINECS 227-118-7DTXSID7063972RefChem:72774DTXCID4042094227-118-75663-29-6SCHEMBL2754170SCHEMBL9734070SCHEMBL27954197SMUIAOJZCSQUSN-UHFFFAOYSA-N
Show more names
NS00033554
Database identifiers
- CAS
5663-29-6- PubChem CID
- 79745
- DTXSID
DTXSID7063972- EC Number
- 227-118-7
- Nikkaji
- J225.084E
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 87.6
Physicochemical properties
- EPA Substance Registry System
- 1 · 1,3-Dioxane, 2-pentyl- (5663-29-6)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: 1,3-Dioxane, 2-pentyl-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,3-Dioxane, 2-pentyl-: INACTIVE
Suppliers1 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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