(2-Hexyl-2-methyl-1,3-dioxolan-4-yl)methanol
Basic information
- CAS
5660-52-6- Standard SMILES
CCCCCCC1(C)OCC(CO)O1- InChIKey
IYIHUBAPCSTQLS-UHFFFAOYSA-N- Molecular formula
- C11H22O3
- Average molar mass
- 202.29 g/mol
- Monoisotopic mass
- 202.15689456
Names & identifiers
- Preferred name
- (2-Hexyl-2-methyl-1,3-dioxolan-4-yl)methanol
- IUPAC
- (2-hexyl-2-methyl-1,3-dioxolan-4-yl)methanol
Names & synonyms
(2-hexyl-2-methyl-1,3-dioxolan-4-yl)methanolDTXSID90972045RefChem:1049692DTXCID1013995345660-52-62-Octanone, cyclic (hydroxymethyl)ethylene acetal2-Hexyl-2-methyl-1,3-dioxolane-4-methanolNSC 27574BRN 0108837AI3-14281NSC275741,3-DIOXOLANE-4-METHANOL, 2-HEXYL-2-METHYL-
Show more names
SCHEMBL1681849NSC-27574
Database identifiers
- CAS
5660-52-6- PubChem CID
- 21868
- DTXSID
DTXSID90972045- Nikkaji
- J42.148K
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 161
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Related reactions
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Compound notes
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