Basic information
- CAS
937-94-0- Standard SMILES
CCCCCCC1(C)OCCO1- InChIKey
HTSKVUFGMXXBAG-UHFFFAOYSA-N- Molecular formula
- C10H20O2
- Average molar mass
- 172.26 g/mol
- Monoisotopic mass
- 172.14632988
Names & identifiers
- Preferred name
- 1,3-Dioxolane, 2-hexyl-2-methyl-
- IUPAC
- 2-hexyl-2-methyl-1,3-dioxolane
- English name
- 2-hexyl-2-methyl-1,3-dioxolane
- Molecular formula
- C10H20O2
- Molecular weight
- 172.2646
Names & synonyms
2-Hexyl-2-methyl-1,3-dioxolane1,3-Dioxolane, 2-hexyl-2-methyl-Methyl hexyl ketone ethylene ketalEINECS 213-335-4AI3-22548DTXSID0061329RefChem:72799DTXCID1048883213-335-4937-94-0SCHEMBL3790700DA-26183
Show more names
2-Methyl-2-hexyl-1,3-dioxolane
NS00039621
Database identifiers
- CAS
937-94-0- PubChem CID
- 70307
- DTXSID
DTXSID0061329- EC Number
- 213-335-4
- Nikkaji
- J298.531D
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 117
Physicochemical properties
- LogP
- 3.011 · 3.011 (est)
- EPA Substance Registry System
- 1 · 1,3-Dioxolane, 2-hexyl-2-methyl- (937-94-0)
- 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.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,3-Dioxolane, 2-hexyl-2-methyl-: INACTIVE
Suppliers2 total
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
BOC Sciences[email protected]
Related reactions
2 records
Compound notes
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