Propanoic acid, 2-[4-(2-aminoethyl)phenoxy]-2-methyl-
Basic information
- CAS
55458-78-1- Standard SMILES
CC(C)(Oc1ccc(CCN)cc1)C(=O)O- InChIKey
RYEJORVMPOOLGZ-UHFFFAOYSA-N- Molecular formula
- C12H17NO3
- Average molar mass
- 223.27 g/mol
- Monoisotopic mass
- 223.1208434
Names & identifiers
- Preferred name
- Propanoic acid, 2-[4-(2-aminoethyl)phenoxy]-2-methyl-
- IUPAC
- 2-[4-(2-aminoethyl)phenoxy]-2-methylpropanoic acid
- English name
- Propanoic acid, 2-[4-(2-aminoethyl)phenoxy]-2-methyl-
- Molecular formula
- C12H17NO3
- Molecular weight
- 223.27
Names & synonyms
55458-78-12-[4-(2-aminoethyl)phenoxy]-2-methylpropanoic acidBezafibrate Impurity 7Propanoic acid, 2-[4-(2-aminoethyl)phenoxy]-2-methyl-2-(4-(2-aminoethyl)phenoxy)-2-methylpropanoic acidSCHEMBL1009896DTXSID90420899NS00007806Benzabate impurity 14Bezafibrate Impurity 9
Database identifiers
- CAS
55458-78-1- PubChem CID
- 5745124
- DTXSID
DTXSID90420899
Properties
Computed structural properties
- XLogP
- -1
- Topological polar surface area
- 72.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 232
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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