2,4-Diaminopyridine

CAT: 0127-OR90697-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR90697-01Size:250 mg

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CAS Number

461-88-1

MDL Number

MFCD00234953

Purity

97%

Smiles

NC1=CC(N)=NC=C1

Chemical Information

2,4-Diaminopyridine

2,4-diaminopyridine is a diaminopyridine.

CAS Number	461-88-1
PubChem CID	68036
IUPAC Name	pyridine-2,4-diamine
Molecular Formula	C5H7N3
Molecular Weight	109.13
XLogP	-0.2
Topological Polar Surface Area	64.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Heavy Atom Count	8
Formal Charge	0
Complexity	74

SMILES

C1=CN=C(C=C1N)N

InChI

InChI=1S/C5H7N3/c6-4-1-2-8-5(7)3-4/h1-3H,(H4,6,7,8)

InChIKey

IFFLKGMDBKQMAH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 461-88-1

CID: 68036

Formula: C5H7N3

MW: 109.13

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	109.13
XLogP3	-0.2
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	109.063997236
Monoisotopic Mass	109.063997236
Topological Polar Surface Area	64.9 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	74.1
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	1
Compound Is Canonicalized	Yes

Catalog	Name
OR13619-01	4-Bromo-2,6-diaminopyridine
OR1010083-01	2,5-Diaminopyridine
OR1010156-01	2,6-Diaminopyridine sulfate
OR6458	2,5-Diaminopyridine dihydrochloride
OR345157-01	5-Chloro-3,4-diaminopyridine
OR345244-01	6-Bromo-2,3-diaminopyridine
PC445029-01	5-Fluoro-2,3-diaminopyridine
OR345148-01	3-Bromo-2,5-diaminopyridine
OR1044905-01	2,6-Diaminopyridine-3,5-dicarbonitrile
OR2132	3-Bromo-2,5-diaminopyridine, 5-CBZ protected

Catalog	Name
271164-01	2,4-Diaminopyridine
430910-01	4-Bromo-2, 6-diaminopyridine
sc-274503	2-Chloro-3,4-diaminopyridine
sc-267307	4-Bromo-2,6-diaminopyridine
270820-01	3,4-Diaminopyridine
GMC33255-01	2,3-Diaminopyridine-4-carbonitrile
FD153008-01	2,5-Diaminopyridine
419591-01	2,3-Diaminopyridine
sc-225761	2,6-Diaminopyridine