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Metformin Hydrochloride
CAS: 1115-70-4 | C4H12ClN5
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
1115-70-4
Molecular Formula:
C4H12ClN5
Molecular Weight:
165.62800000000001 g/mol
Names and Synonyms:
Metformin Hydrochloride
Obimat-SR
FORTAMET
Diabetmim
Neodipa
Metgluco
Glumin XR
Riomet
Glucoformin
N,N-Dimethylbiguanidine monohydrochloride
Melbin
Glucophage SR
Glifage
Glumetza
Brot
Apo-Metformin
N,N-Dimethylbiguanidinium chloride
Glucophage XR
Dialon
Diabetosan
Glyceriphage
Diformin
Diaformin
Walaphage
Siamformet
Orabet
Miformin
Metomin
Metforal
Glycon
Glyciphage
Glupermin
Glumin
Glumeformin
Gluformin
Glufor
Gludepatic
Glucophage Retard
Glucophage-Mite
Glucophage Forte
Glucophage 850
Gluconil
Glucomin
Glucoform
Glucomine
Glucomet
Glucofago
Glucaminol
Geamet
Fornidd
Dimefor
Diformin Retard
Benofomin
Apophage
Diabex
Diabetmin
Dextin
Denkaform
Dabex
LA 6023
Glyformin
Glucophage
Diabefagos
N1,N1-Dimethylbiguanide hydrochloride
Meguan
1,1-Dimethylbiguanide hydrochloride
N,N-Dimethylbiguanide hydrochloride
Metformin hydrochloride
Biguanide, 1,1-dimethyl-, hydrochloride
Imidodicarbonimidic diamide, N,N-dimethyl-, monohydrochloride
Biguanide, 1,1-dimethyl-, monohydrochloride
Imidodicarbonimidic diamide, N,N-dimethyl-, hydrochloride (1:1)
Identifiers:
SMILES:
CN(C)C(=N)NC(=N)N.Cl
InChI:
InChI=1S/C4H11N5.ClH/c1-9(2)4(7)8-3(5)6;/h1-2H3,(H5,5,6,7,8);1H
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
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 165.62800000000001 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 165.07812306399998 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 10 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 2 count | RDKit |
| Hydrogen Bond Donors | 4 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 0 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 88.99000000000001 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | -0.6123600000000003 | RDKit |
| molecular_mass | 165.63 g/mol | Legacy Database |
| cas-canonical-smile | Cl.N=C(N)NC(=N)N(C)C None | Legacy Database |
| cas-inchi | InChI=1S/C4H11N5.ClH/c1-9(2)4(7)8-3(5)6;/h1-2H3,(H5,5,6,7,8);1H None | Legacy Database |
| cas-inchi-key | InChIKey=OETHQSJEHLVLGH-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 232 °C None | Legacy Database |
| cas-name | Metformin hydrochloride None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 43.71150000000001 | RDKit |
