1-Methylbiguanide hydrochloride supplier

Name
METFORMIN RELATED COMPOUND B (25 MG) (1-METHYLBIGUANIDE HYDROCHLORIDE)
EINECS
CAS No. 1674-62-0
Density 1.45 g/cm³
Solubility
Melting Point
Formula C₃H₁₀ClN₅
Boiling Point 225 °C at 760 mmHg
Molecular Weight 151.599
Flash Point 89.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Biguanide,1-methyl-, hydrochloride (6CI,7CI,8CI);Imidodicarbonimidic diamide, N-methyl-,monohydrochloride (9CI);N'-Methylbiguanide monohydrochloride;
PSA 97.78000
LogP 1.10720

Synthetic route

: 593-51-1
methylamine hydrochloride

: 127099-85-8, 780722-26-1
N-Cyanoguanidine

: 1674-62-0
N1-methyl biguanide hydrochloride

Conditions

Conditions	Yield
In butan-1-ol for 15h; Reflux;	61%

: 1674-62-0
N1-methyl biguanide hydrochloride

: 24044-87-9
methyl (1,3-benzothiazol-2-ylsulfanyl)acetate

: 6-(benzothiazol-2-ylsulfanylmethyl)-N-methyl-[1,3,5]triazine-2,4-diamine

Conditions

Conditions	Yield
Stage #1: N1-methyl biguanide hydrochloride With sodium methylate In methanol at 20℃; for 0.5h; Stage #2: methyl (1,3-benzothiazol-2-ylsulfanyl)acetate In methanol for 10h; Heating;	73%

: 593-51-1
methylamine hydrochloride

: 1674-62-0
N1-methyl biguanide hydrochloride

A: 471-29-4
1-methylguanidine

B: 113-00-8
guanidine nitrate

Conditions

Conditions	Yield
beim Erhitzen;

...Expand

: 1674-62-0
N1-methyl biguanide hydrochloride

A: 420-04-2
CYANAMID

B: 471-29-4
1-methylguanidine

C: 50-01-1
guanidine hydrochloride

D: 4674-68-4
methylcyanamide

Conditions

Conditions	Yield
bei der thermischen Zersetzung;

...Expand

: ammonium chloride

: 1674-62-0
N1-methyl biguanide hydrochloride

A: 471-29-4
1-methylguanidine

B: 113-00-8
guanidine nitrate

Conditions

Conditions	Yield
beim Erhitzen;

...Expand

1-Methylbiguanide hydrochloride Specification

The 1-Methylbiguanide hydrochloride, with the CAS registry number 1674-62-0, is also known as N-Methylimidodicarbonimidic diamide monohydrochloride. This chemical's molecular formula is C₃H₁₀ClN₅ and molecular weight is 151.598. Its IUPAC name is called 1-(diaminomethylidene)-2-methylguanidine hydrochloride. This chemical's classification code is Drug / Therapeutic Agent.

Physical properties of 1-Methylbiguanide hydrochloride: (1)ACD/LogP: -1.79; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -4; (4)ACD/LogD (pH 7.4): -4; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 5; (10)#H bond donors: 6; (11)#Freely Rotating Bonds: 1; (12)Flash Point: 89.9 °C; (13)Enthalpy of Vaporization: 46.15 kJ/mol; (14)Boiling Point: 225 °C at 760 mmHg; (15)Vapour Pressure: 0.0885 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CN=C(N)N=C(N)N.Cl
(2)InChI: InChI=1S/C3H9N5.ClH/c1-7-3(6)8-2(4)5;/h1H3,(H6,4,5,6,7,8);1H
(3)InChIKey: AAYCPBAOUJRPIC-UHFFFAOYSA-N

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Source
mouse	LD50	intraperitoneal	470mg/kg (470mg/kg)	Pharmacological Research Communications. Vol. 6, Pg. 117, 1974.
mouse	LD50	oral	1750mg/kg (1750mg/kg)	Arzneimittel-Forschung. Drug Research. Vol. 12, Pg. 314, 1962.
rat	LD50	intraperitoneal	325mg/kg (325mg/kg)	Farmaco, Edizione Scientifica. Vol. 15, Pg. 521, 1960.
rat	LD50	oral	1754mg/kg (1754mg/kg)	Farmaco, Edizione Scientifica. Vol. 15, Pg. 521, 1960.

Product Name

METFORMIN RELATED COMPOUND B (25 MG) (1-METHYLBIGUANIDE HYDROCHLORIDE)

Synthetic route

1-Methylbiguanide hydrochloride Specification

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