2-ethynyl-4-nitropyridine

2-ethynyl-4-nitropyridine

CAS: 1211515-78-4

Formula: C7H4N2O2

SMILES: [O-][N+](=O)C1=CC(=NC=C1)C#C

IUPAC: 2-ethynyl-4-nitropyridine

InChI: InChI=1S/C7H4N2O2/c1-2-6-5-7(9(10)11)3-4-8-6/h1,3-5H

Composition: C (56.76%), H (2.72%), N (18.91%), O (21.60%)

Molar Mass: 148.121

Atom Count: 15

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	148.027277377
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	ACBLXJUJZVBWQS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	35.02
Topological Polar Surface Area	56.03
Polarizability	13.92
Ring Count	1
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	1211515-78-4		$65.57-$239.59$65.57$103.40$239.59