Back to Search
Midodrine Hydrochloride
CAS: 3092-17-9 | C12H19ClN2O4
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
3092-17-9
Molecular Formula:
C12H19ClN2O4
Molecular Mass:
290.75 g/mol
Names and Synonyms:
Midodrine Hydrochloride
Acetamide, 2-amino-N-[2-(2,5-dimethoxyphenyl)-2-hydroxyethyl]-, hydrochloride (1:1)
Acetamide, 2-amino-N-[2-(2,5-dimethoxyphenyl)-2-hydroxyethyl]-, monohydrochloride
Acetamide, 2-amino-N-(β-hydroxy-2,5-dimethoxyphenethyl)-, hydrochloride
Midodrine hydrochloride
TS 701
St 1085
Gutron
(±)-Midodrine hydrochloride
(±)-Midodrin hydrochloride
ProAmatine
Hipertan
Alphamine
A 4020 Linz
Amatine
St. Peter 224
Midamine
Metligene
2-Amino-N-(2-(2,5-dimethoxyphenyl)-2-hydroxyethyl)acetamide hydrochloride
Identifiers:
SMILES:
COc1ccc(OC)c(C(O)CN=C(O)CN)c1.Cl
InChI:
InChI=1S/C12H18N2O4.ClH/c1-17-8-3-4-11(18-2)9(5-8)10(15)7-14-12(16)6-13;/h3-5,10,15H,6-7,13H2,1-2H3,(H,14,16);1H
Key Properties
Melting Point
192-193 °C
CAS Common Chemistry
Density
1.37 g/cm³
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 | 290.75 g/mol | CAS Common Chemistry |
| 290.74699999999996 g/mol | RDKit | |
| 290.103334768 g/mol | RDKit | |
| Density | 1.37 g/cm³ | CAS Common Chemistry |
| 1.371 g/cm3 | CAS Common Chemistry | |
| Canonical SMILES | Cl.O=C(NCC(O)C1=CC(OC)=CC=C1OC)CN | CAS Common Chemistry |
| InChI | InChI=1S/C12H18N2O4.ClH/c1-17-8-3-4-11(18-2)9(5-8)10(15)7-14-12(16)6-13;/h3-5,10,15H,6-7,13H2,1-2H3,(H,14,16);1H | CAS Common Chemistry |
| InChI Key | InChIKey=MGCQZNBCJBRZDT-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 192-193 °C | CAS Common Chemistry |
| Name | Midodrine hydrochloride | CAS Common Chemistry |
| Heavy Atom Count | 19 | RDKit |
| Hydrogen Bond Acceptors | 5 | RDKit |
| Hydrogen Bond Donors | 3 | RDKit |
| Rotatable Bonds | 6 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 97.3 Ų | RDKit |
| LogP | 1.0741999999999998 | RDKit |
| Molar Refractivity | 75.73900000000003 | RDKit |
