Biguanide hydrochloride

CAT: 0926-FB150835-01Size: 5 gDry Ice: NoHazardous: No

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CAT#:0926-FB150835-01Size:5 g

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CAS Number

4761-93-7

MDL Number

MFCD01740274

Smiles

C (=NC (=N) N) (N) N.Cl

Molecular Formula

C2H8ClN5

Molecular Weight

137.57 g/mol

Controlled

Chemical Information

Imidodicarbonimidic diamide, hydrochloride (1:1)

CAS Number	4761-93-7
PubChem CID	12219220
IUPAC Name	1-(diaminomethylidene)guanidine;hydrochloride
Molecular Formula	C2H8ClN5
Molecular Weight	137.57
Topological Polar Surface Area	114
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	8
Formal Charge	0
Complexity	98

SMILES

C(=NC(=N)N)(N)N.Cl

InChI

InChI=1S/C2H7N5.ClH/c3-1(4)7-2(5)6;/h(H7,3,4,5,6,7);1H

InChIKey

FKPUYTAEIPNGRM-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 4761-93-7

CID: 12219220

Formula: C2H8ClN5

MW: 137.57

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	137.57
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	137.0468230
Monoisotopic Mass	137.0468230
Topological Polar Surface Area	114 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	98.6
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

Catalog	Name
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FH64922-01	Talibegron hydrochloride
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Catalog	Name
TRC-B016556-2.5G	Biguanide Hydrochloride
AR-P29465-01	Polyhexamethylene biguanide hydrochloride
587078-01	Polyhexamethylene Biguanide Hydrochloride, Solid
JH256106	Poly (hexamethylene biguanide) hydrochloride
TRC-C378540-1G	1-(4-Chlorophenyl)biguanide Hydrochloride
sc-222473	1- (2-Fluorophenyl) biguanide hydrochloride
OR3912-01	1- (2-Chlorophenyl) biguanide hydrochloride
sc-222561A	1- (4-Fluorophenyl) biguanide hydrochloride
286615-01	Polyhexamethylene Biguanide Hydrochloride, 20% solution
407824-01	1- (3-Chlorophenyl) biguanide Hydrochloride