3,4-diaminopyridin-1-ium-1-olate

3,4-diaminopyridin-1-ium-1-olate

CAS: 927814-75-3

Formula: C5H7N3O

SMILES: NC1=CC=[N+]([O-])C=C1N

IUPAC: 3,4-diaminopyridin-1-ium-1-olate

InChI: InChI=1S/C5H7N3O/c6-4-1-2-8(9)3-5(4)7/h1-3H,6-7H2

Composition: C (47.99%), H (5.64%), N (33.58%), O (12.79%)

Molar Mass: 125.131

Atom Count: 16

Heavy Atom Count: 9

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	125.058911857
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	JTJCKVXJDDWSHD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	36.61
Topological Polar Surface Area	78.98
Polarizability	12.2
Ring Count	1
Rotatable Bond Count	0

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<7 Days	927814-75-3		$205.97-$2,550.24$205.97$427.46$851.81$2,550.24