N,N-dimethyl-3-(3,5-di-t-butyl-4-hydroxybenzyl)-ammonium chloride
Basic information
- CAS
892-75-1- Standard SMILES
C[NH+](C)Cc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1.[Cl-]- InChIKey
XPUBCCUJVHXZCV-UHFFFAOYSA-N- Molecular formula
- C17H30ClNO
- Average molar mass
- 299.9 g/mol
- Monoisotopic mass
- 299.2015923
Overview
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Names & identifiers
- Preferred name
- N,N-dimethyl-3-(3,5-di-t-butyl-4-hydroxybenzyl)-ammonium chloride
- IUPAC
- (3,5-ditert-butyl-4-hydroxyphenyl)methyl-dimethylazanium chloride
Names & synonyms
N,N-dimethyl-3-(3,5-di-t-butyl-4-hydroxybenzyl)-ammonium chloride
Database identifiers
- CAS
892-75-1- PubChem CID
- 73557516
Properties
Computed structural properties
- Topological polar surface area
- 24.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 261
Related reactions
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Compound notes
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