Basic information
- CAS
36846-57-8- Standard SMILES
CC(CN1CCCC1)OC(=O)c1ccccc1.Cl- InChIKey
WOWNYUXFUBQYQP-UHFFFAOYSA-N- Molecular formula
- C14H20ClNO2
- Average molar mass
- 269.77 g/mol
- Monoisotopic mass
- 269.1182566
Names & identifiers
- Preferred name
- 1-Pyrrolidineethanol, alpha-methyl-, benzoate (ester), hydrochloride
- IUPAC
- 1-pyrrolidin-1-ylpropan-2-yl benzoate;hydrochloride
- English name
- 1-pyrrolidin-1-ylpropan-2-yl benzoate hydrochloride
- Molecular formula
- C14H20ClNO2
- Molecular weight
- 0
Names & synonyms
36846-57-81-Pyrrolidineethanol, alpha-methyl-, benzoate (ester), hydrochlorideRefChem:10570951-(1-Pyrrolidinyl)-2-propanol benzoate hydrochloridealpha-Methyl-1-pyrrolidineethanol benzoate (ester) hydrochlorideDTXSID809580501-(Pyrrolidin-1-yl)propan-2-yl benzoate--hydrogen chloride (1/1)1-pyrrolidin-1-ylpropan-2-yl benzoate hydrochloride
Database identifiers
- CAS
36846-57-8- PubChem CID
- 215938
- DTXSID
DTXSID80958050
Properties
Computed structural properties
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 243
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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