1-Methylbiguanide
Basic information
- CAS
1609-00-3- Standard SMILES
CN=C(N)N=C(N)N- InChIKey
JLPWQEHTPOFCPG-UHFFFAOYSA-N- Molecular formula
- C3H9N5
- Average molar mass
- 115.14 g/mol
- Monoisotopic mass
- 115.08579531
Names & identifiers
- Preferred name
- 1-Methylbiguanide
- IUPAC
- 1-(diaminomethylidene)-2-methylguanidine
- English name
- 1-Methylbiguanide sulphate
- Molecular formula
- C3H9N5
- Molecular weight
- 115.14
Names & synonyms
1609-00-3DTXSID10167032RefChem:76370DTXCID4089523Metformin hydrochloride impurity E1-METHYL-BIGUANIDE1-MethylbiguanideBIGUANIDE, 1-METHYL-IMIDODICARBONIMIDIC DIAMIDE, N-METHYL-K9BB0L32CHMETFORMIN HYDROCHLORIDE IMPURITY E (EP IMPURITY)METFORMIN HYDROCHLORIDE IMPURITY E [EP IMPURITY]
Show more names
MonomethylbiguanideMetformin USP Impurity B1-Methylbiguanide sulphate1-METHYLBIGUANIDE SULPHATE 95%Imidodicarbonimidicdiamide, N-methyl-Metformin EP Impurity E(Not Continue)
Metformin hydrochloride impurity E [EP]N-METHYL-IMIDODICARBONIMIDIC DIAMIDEN-METHYL-N'-GUANYLGUANIDINEUNII-K9BB0L32CH1-(diaminomethylidene)-2-methylguanidineN-methylimidodicarbonimidic diamideMetformin EP impurity EMethylbiguanid
Database identifiers
- CAS
1609-00-3- PubChem CID
- 15486
- DTXSID
DTXSID10167032
Properties
Computed structural properties
- XLogP
- -1.8
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 120
Physicochemical properties
- Melting point
- 107 · 107-108 °C
- Boiling point
- 165.3 · 165.3±23.0 °C(Predicted)
- Density
- 1.45 · 1.45±0.1 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C, protect from light
- pka
- 12.77 · 12.77±0.10(Predicted)
- Appearance
- White to off-white Solid
- FDA UNII
- 9 BB0L32CH · K9BB0L32CH
Chemistry & industry
Applications
UsesN-Demethylated analog of Metformin (M258815) with stimulatory effects on the intracellular portion of human insulin receptor (IPβIRK).
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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