Back to Search
Tyramine Hydrochloride
CAS: 60-19-5 | C8H12ClNO
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
60-19-5
Molecular Formula:
C8H12ClNO
Molecular Mass:
173.64 g/mol
Names and Synonyms:
Tyramine Hydrochloride
Phenol, 4-(2-aminoethyl)-, hydrochloride (1:1)
Phenol, p-(2-aminoethyl)-, hydrochloride
Phenol, 4-(2-aminoethyl)-, hydrochloride
4-Hydroxyphenethylamine hydrochloride
Tyramine hydrochloride
p-Tyramine hydrochloride
4-Hydroxy-β-phenethylamine hydrochloride
2-(4-Hydroxyphenyl)ethylamine hydrochloride
Uteramin
Mydrial
Tyrosam
4-Hydroxyphenylethylamine hydrochloride
Identifiers:
SMILES:
Cl.NCCc1ccc(O)cc1
InChI:
InChI=1S/C8H11NO.ClH/c9-6-5-7-1-3-8(10)4-2-7;/h1-4,10H,5-6,9H2;1H
Key Properties
Melting Point
269 °C
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 173.64 g/mol | CAS Common Chemistry |
| 173.643 g/mol | RDKit | |
| 173.060741684 g/mol | RDKit | |
| Canonical SMILES | Cl.OC1=CC=C(C=C1)CCN | CAS Common Chemistry |
| InChI | InChI=1S/C8H11NO.ClH/c9-6-5-7-1-3-8(10)4-2-7;/h1-4,10H,5-6,9H2;1H | CAS Common Chemistry |
| InChI Key | InChIKey=RNISDHSYKZAWOK-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 269 °C | CAS Common Chemistry |
| Name | Tyramine hydrochloride | CAS Common Chemistry |
| Heavy Atom Count | 11 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 46.25 Ų | RDKit |
| LogP | 1.3152000000000001 | RDKit |
| Molar Refractivity | 48.11320000000002 | RDKit |
