1-Piperidinepropionic acid, beta-(3,4-dimethoxyphenyl)-, methyl ester, hydrochloride
Basic information
- CAS
7163-83-9- Standard SMILES
COC(=O)CC(c1ccc(OC)c(OC)c1)N1CCCCC1.Cl- InChIKey
YSBSRNLYMVGBDA-UHFFFAOYSA-N- Molecular formula
- C17H26ClNO4
- Average molar mass
- 343.8 g/mol
- Monoisotopic mass
- 343.155036
Names & identifiers
- Preferred name
- 1-Piperidinepropionic acid, beta-(3,4-dimethoxyphenyl)-, methyl ester, hydrochloride
- IUPAC
- methyl 3-(3,4-dimethoxyphenyl)-3-piperidin-1-ylpropanoate;hydrochloride
Names & synonyms
7163-83-91-Piperidinepropionic acid, beta-(3,4-dimethoxyphenyl)-, methyl ester, hydrochlorideRefChem:1056826beta-(3,4-Dimethoxyphenyl)-1-piperidinepropionic acid methyl ester hydrochlorideDTXSID70992206Methyl 3-(3,4-dimethoxyphenyl)-3-(piperidin-1-yl)propanoate--hydrogen chloride (1/1)
Database identifiers
- CAS
7163-83-9- PubChem CID
- 201937
- DTXSID
DTXSID70992206
Properties
Computed structural properties
- Topological polar surface area
- 48 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 344
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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