1-(2-Tert-butylphenoxy)-3-(1-pyrrolidinyl)-2-propanol hydrochloride
Basic information
- CAS
471916-80-0- Standard SMILES
CC(C)(C)c1ccccc1OCC(O)CN1CCCC1.Cl- InChIKey
ZWGYFXDTIKEAEZ-UHFFFAOYSA-N- Molecular formula
- C17H28ClNO2
- Average molar mass
- 313.9 g/mol
- Monoisotopic mass
- 313.1808568
Names & identifiers
- Preferred name
- 1-(2-Tert-butylphenoxy)-3-(1-pyrrolidinyl)-2-propanol hydrochloride
- IUPAC
- 1-(2-tert-butylphenoxy)-3-pyrrolidin-1-ylpropan-2-ol;hydrochloride
Names & synonyms
1-(2-tert-butylphenoxy)-3-(1-pyrrolidinyl)-2-propanol hydrochloride471916-80-0DTXSID001379696SR-01000222504SR-01000222504-11-(2-tert-butylphenoxy)-3-pyrrolidin-1-ylpropan-2-ol;hydrochloride1-Pyrrolidineethanol, I+/--[[2-(1,1-dimethylethyl)phenoxy]methyl]-, hydrochloride (1:1)
Database identifiers
- CAS
471916-80-0- PubChem CID
- 2874352
- DTXSID
DTXSID001379696
Properties
Computed structural properties
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 281
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Compound notes
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