D,L-Noradrenaline | SBID = 1283 | Compound |
Structure
Molecular Properties
| Interactions: | 4 | ||
| PubChem TPSA/Å2: | 86.7 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | -1.2 | ||
| Hydrophilicity (Cheng XLogP3): | |||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 4.0 | ||
| Number of H-Bond Acceptors: | 4.0 | ||
| Number of Stereogenic Bonds (E/Z): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 1.0 | ||
| 3D Volume/Å3: | 129.0 | ||
| Sum Formula: | C8H11NO3 | ||
| M / g/mol: | 169.18 | ||
| Complexity: | 142.0 | ||
| Number of Conformers: | 9.0 |
Identifiers
- Tags: neurotransmitter, aromatic, drug, typical guest
- Name: D,L-Noradrenaline
- Preferred Abbreviation: D,L-Noradrenaline
- IUPAC Name: 4-(2-amino-1-hydroxyethyl)benzene-1,2-diol
- CAS: 138-65-8
- CID: 951
- InChiKey: SFLSHLFXELFNJZ-UHFFFAOYSA-N
- InChi: InChI=1S/C8H11NO3/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-3,8,10-12H,4,9H2
- CanoSmiles: C1=CC(=C(C=C1C(CN)O)O)O
- IsoSmiles: C1=CC(=C(C=C1C(CN)O)O)O
