Basic information
- CAS
2409-79-2- Standard SMILES
Br.CCCC1(c2ccccc2O)CCN(C)C1- InChIKey
XOLVXYZMGOXSPF-UHFFFAOYSA-N- Molecular formula
- C14H22BrNO
- Average molar mass
- 300.23 g/mol
- Monoisotopic mass
- 299.08848
Names & identifiers
- Preferred name
- Phenol, 2-(1-methyl-3-propyl-3-pyrrolidinyl)-, hydrobromide (1:1)
- IUPAC
- 2-(1-methyl-3-propylpyrrolidin-3-yl)phenol;hydrobromide
Names & synonyms
2409-79-2RefChem:1094809Phenol, 2-(1-methyl-3-propyl-3-pyrrolidinyl)-, hydrobromide (1:1)o-(1-Methyl-3-propyl-3-pyrrolidinyl)phenol hydrobromidePhenol, o-(1-methyl-3-propyl-3-pyrrolidinyl)-, hydrobromide3-(o-Hydroxymethyl)-1-methyl-3-propylpyrrolidine hydrobromideDTXSID309469272-(1-Methyl-3-propylpyrrolidin-3-yl)phenol--hydrogen bromide (1/1)
Database identifiers
- CAS
2409-79-2- PubChem CID
- 200635
- DTXSID
DTXSID30946927
Properties
Computed structural properties
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 231
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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