Basic information
- CAS
27577-96-4- Standard SMILES
Cc1ccc(CCO)cc1C.Cc1cccc(C)c1CCO.Cc1cccc(CCO)c1C- InChIKey
GEKLNWIYEDORQX-UHFFFAOYSA-N- Molecular formula
- C30H42O3
- Average molar mass
- 450.7 g/mol
- Monoisotopic mass
- 450.3133952
Names & identifiers
- Preferred name
- 2-Xylylethanol
- IUPAC
- 2-(2,3-dimethylphenyl)ethanol;2-(2,6-dimethylphenyl)ethanol;2-(3,4-dimethylphenyl)ethanol
- English name
- 2-Xylylethanol
- Molecular weight
- 0
Names & synonyms
2-XYLYLETHANOL
Database identifiers
- CAS
27577-96-4- PubChem CID
- 33940
Properties
Computed structural properties
- Topological polar surface area
- 60.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 324
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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