Ethyl 4-amino-2-(4-methoxyphenyl)butanoate--hydrogen chloride (1/1)
Basic information
- CAS
66859-68-5- Standard SMILES
CCOC(=O)C(CC[NH3+])c1ccc(OC)cc1.[Cl-]- InChIKey
XWAOXDHAVCZJQD-UHFFFAOYSA-N- Molecular formula
- C13H20ClNO3
- Average molar mass
- 273.75 g/mol
- Monoisotopic mass
- 273.1131712
Names & identifiers
- Preferred name
- Ethyl 4-amino-2-(4-methoxyphenyl)butanoate--hydrogen chloride (1/1)
- IUPAC
- [4-ethoxy-3-(4-methoxyphenyl)-4-oxobutyl]azanium chloride
Names & synonyms
66859-68-5DTXSID20985481Ethyl 4-amino-2-(4-methoxyphenyl)butanoate--hydrogen chloride (1/1)RefChem:1084927DTXCID001412674Ethyl 4-amino-2-(p-methoxyphenyl)butyrate hydrochlorideBUTYRIC ACID, 4-AMINO-2-(p-METHOXYPHENYL)-, ETHYL ESTER, HYDROCHLORIDE
Database identifiers
- CAS
66859-68-5- PubChem CID
- 48215
Properties
Computed structural properties
- Topological polar surface area
- 63.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 225
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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