Molecule record

5-[2-(tert-butylamino)-1-hydroxyethyl]benzene-1,3-diol

C12H19NO3

225.29 g/mol

Loading structure

Molecular properties

Formula
C12H19NO3
Molar mass
225.29 g·mol−1
Exact mass
225.1365 Da
4
PubChem CID
5403

Functional groups

Alcohol
Alkane / alkyl carbon
Aromatic ring
Phenol
Secondary amine

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • 1,3-Benzenediol, 5-[2-[(1,1-dimethylethyl)amino]-1-hydroxyethyl]-
  • 23031-25-6
  • 245-385-8
  • 5-(2-((1,1-DIMETHYLETHYL)AMINO)-1-HYDROXYETHYL)-1,3-BENZENEDIOL
  • Asthmasian
  • Brethine
  • Brican
  • Bricar
Show all 24 synonyms
  • Bricaril
  • Bricyn
  • Butalitab
  • CHEBI:9449
  • DTXCID001310
  • DTXSID7021310
  • N8ONU3L3PG
  • R03AC03
  • R03CC03
  • RefChem:56527
  • Terbutalin
  • Terbutalin ratiopharm
  • Terbutalina
  • Terbutalina [DCIT]
  • Terbutalinum
  • terbutaline

Structure identifiers

Canonical SMILES
CC(C)(C)NCC(O)c1cc(O)cc(O)c1
Isomeric SMILES
CC(C)(C)NCC(C1=CC(=CC(=C1)O)O)O
InChI
InChI=1S/C12H19NO3/c1-12(2,3)13-7-11(16)8-4-9(14)6-10(15)5-8/h4-6,11,13-16H,7H2,1-3H3
InChIKey
XWTYSIMOBUGWOL-UHFFFAOYSA-N
PubChem CID
5403

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for 5-[2-(tert-butylamino)-1-hydroxyethyl]benzene-1,3-diol; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 5-[2-(tert-butylamino)-1-hydroxyethyl]benzene-1,3-diol; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

Open source record