Molecule record

1-(4-amino-3,5-dichlorophenyl)-2-(tert-butylamino)ethanol

C12H18Cl2N2O

277.19 g/mol

Loading structure

Molecular properties

Formula
C12H18Cl2N2O
Molar mass
277.19 g·mol−1
Exact mass
276.0796 Da
4
PubChem CID
2783

Functional groups

Alcohol
Alkane / alkyl carbon
Aromatic ring
Aryl halide
Primary amine
Secondary amine

Physical properties

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

Common names and synonyms

  • (+-)-clenbuterol
  • 1-(4-Amino-3,5-dichloro-phenyl)-2-tert-butylamino-ethanol
  • 253-366-0
  • 256-529-4
  • 37148-27-9
  • 4-Amino-3,5-dichloro-alpha-(((1,1-dimethylethyl)amino)methyl)benzenemethanol
  • BENZENEMETHANOL, 4-AMINO-3,5-DICHLORO-alpha-(((1,1-DIMETHYLETHYL)AMINO)METHYL)-
  • CHEBI:174690
Show all 24 synonyms
  • Clenbuterolum
  • Clenbuterolum [INN-Latin]
  • Contraspasmin
  • DTXCID902833
  • DTXSID7022833
  • Monores
  • NAB 365
  • NSC-758633
  • Planipart
  • R03AC14
  • R03CC13
  • RefChem:56552
  • Spiropent mite
  • XTZ6AXU7KN
  • clenbuterol
  • clenbuterolo

Structure identifiers

Canonical SMILES
CC(C)(C)NCC(O)c1cc(Cl)c(N)c(Cl)c1
Isomeric SMILES
CC(C)(C)NCC(C1=CC(=C(C(=C1)Cl)N)Cl)O
InChI
InChI=1S/C12H18Cl2N2O/c1-12(2,3)16-6-10(17)7-4-8(13)11(15)9(14)5-7/h4-5,10,16-17H,6,15H2,1-3H3
InChIKey
STJMRWALKKWQGH-UHFFFAOYSA-N
PubChem CID
2783

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 1-(4-amino-3,5-dichlorophenyl)-2-(tert-butylamino)ethanol; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 1-(4-amino-3,5-dichlorophenyl)-2-(tert-butylamino)ethanol; 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