Basic information
- CAS
7376-69-4- Standard SMILES
CCCNCC(O)c1ccc(O)c(O)c1- InChIKey
FJPVLTFQDJDLPR-UHFFFAOYSA-N- Molecular formula
- C11H17NO3
- Average molar mass
- 211.26 g/mol
- Monoisotopic mass
- 211.1208434
Names & identifiers
- Preferred name
- 4-(1-Hydroxy-2-(propylamino)ethyl)-1,2-benzenediol
- IUPAC
- 4-[1-hydroxy-2-(propylamino)ethyl]benzene-1,2-diol
Names & synonyms
7376-69-4RefChem:10697164-(1-Hydroxy-2-(propylamino)ethyl)-1,2-benzenediol3,4-Dihydroxy-alpha-((propylamino)methyl)benzyl alcoholPropyladrenalineWIN 5587BRN 3285585AthyladrenalinProtocatechuyl alcohol, alpha-(propylaminomethyl)-4-[1-hydroxy-2-(propylamino)ethyl]benzene-1,2-diolBENZYL ALCOHOL, 3,4-DIHYDROXY-alpha-((PROPYLAMINO)METHYL)-SCHEMBL3503273
Show more names
DTXSID50994667
Database identifiers
- CAS
7376-69-4- PubChem CID
- 23845
- DTXSID
DTXSID50994667
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 72.7 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 177
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…