Basic information
- CAS
61035-91-4- Standard SMILES
CC(=O)Oc1cccc(CCN)c1.Cl- InChIKey
DBYCQCVFEMSXSG-UHFFFAOYSA-N- Molecular formula
- C10H14ClNO2
- Average molar mass
- 215.67 g/mol
- Monoisotopic mass
- 215.0713064
Names & identifiers
- Preferred name
- Phenol, 3-(2-aminoethyl)-, acetate (ester), hydrochloride
- IUPAC
- [3-(2-aminoethyl)phenyl] acetate;hydrochloride
Names & synonyms
Phenol, 3-(2-aminoethyl)-, acetate (ester), hydrochloride3-(2-Aminoethyl)phenol acetate (ester) hydrochloride61035-91-4DTXSID60209916RefChem:369126DTXCID101324073-(2-Aminoethyl)phenyl acetate--hydrogen chloride (1/1)
Database identifiers
- CAS
61035-91-4- PubChem CID
- 3045704
- DTXSID
DTXSID60209916
Properties
Computed structural properties
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 170
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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