4-Methylpicolinimidamide hydrochloride

CAT: 0127-OR1050048-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1050048-01Size:100 mg

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CAS Number

1179360-90-7

MDL Number

MFCD12755542

Purity

95%

Smiles

N=C(N)C1=NC=CC(C)=C1.[H]Cl

Chemical Information

4-Methylpicolinimidamide hydrochloride

CAS Number	1179360-90-7
PubChem CID	53484928
IUPAC Name	4-methylpyridine-2-carboximidamide;hydrochloride
Molecular Formula	C7H10ClN3
Molecular Weight	171.63
Topological Polar Surface Area	62.8
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	11
Formal Charge	0
Complexity	133

SMILES

CC1=CC(=NC=C1)C(=N)N.Cl

InChI

InChI=1S/C7H9N3.ClH/c1-5-2-3-10-6(4-5)7(8)9;/h2-4H,1H3,(H3,8,9);1H

InChIKey

PMQWCPOFTQFDGM-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1179360-90-7

CID: 53484928

Formula: C7H10ClN3

MW: 171.63

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	171.63
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	171.0563250
Monoisotopic Mass	171.0563250
Topological Polar Surface Area	62.8 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	133
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

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