Basic information
- CAS
63980-38-1- Standard SMILES
CCCCC(C)C1(C)OCC(CO)O1- InChIKey
HADGDWQOEKNXOZ-UHFFFAOYSA-N- Molecular formula
- C11H22O3
- Average molar mass
- 202.29 g/mol
- Monoisotopic mass
- 202.15689456
Names & identifiers
- Preferred name
- 1,3-Dioxolane-4-methanol, 2-methyl-2-(methylpentyl)-
- IUPAC
- (2-hexan-2-yl-2-methyl-1,3-dioxolan-4-yl)methanol
Names & synonyms
2-Methyl-2-(methylpentyl)-1,3-dioxolane-4-methanol63980-38-11,3-DIOXOLANE-4-METHANOL, 2-METHYL-2-(METHYLPENTYL)-RefChem:219002[2-(Hexan-2-yl)-2-methyl-1,3-dioxolan-4-yl]methanolDTXSID50981577
Database identifiers
- CAS
63980-38-1- PubChem CID
- 45947
- DTXSID
DTXSID50981577- Nikkaji
- J83.708C
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 172
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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