Basic information
- CAS
41457-10-7- Standard SMILES
CC1(C)CC(C)(C)[NH+]1CC(O)COc1ccccc1.[Cl-]- InChIKey
OCXZHMYZLSZTPJ-UHFFFAOYSA-N- Molecular formula
- C16H26ClNO2
- Average molar mass
- 299.83 g/mol
- Monoisotopic mass
- 299.1652068
Names & identifiers
- Preferred name
- 1-Azetidineethanol, alpha-(phenoxymethyl)-2,2,4,4-tetramethyl-, hydrochloride
- IUPAC
- 1-phenoxy-3-(2,2,4,4-tetramethylazetidin-1-ium-1-yl)propan-2-ol chloride
Names & synonyms
1-AZETIDINEETHANOL, alpha-(PHENOXYMETHYL)-2,2,4,4-TETRAMETHYL-, HYDROCHLORIDE41457-10-7RefChem:1054874alpha-(Phenoxymethyl)-2,2,4,4-tetramethyl-1-azetidineethanol hydrochloride
Database identifiers
- CAS
41457-10-7- PubChem CID
- 38869
Properties
Computed structural properties
- Topological polar surface area
- 33.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 281
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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