6-methoxy-5-nitroisoquinoline

6-methoxy-5-nitroisoquinoline

CAS: 72677-92-0

Formula: C10H8N2O3

SMILES: COC1=C(C2=CC=NC=C2C=C1)[N+]([O-])=O

IUPAC: 6-methoxy-5-nitroisoquinoline

InChI: InChI=1S/C10H8N2O3/c1-15-9-3-2-7-6-11-5-4-8(7)10(9)12(13)14/h2-6H,1H3

Composition: C (58.82%), H (3.95%), N (13.72%), O (23.51%)

Molar Mass: 204.185

Atom Count: 23

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	204.053492126
Formal Charge	0
FSP3	0.1
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	NDSGVVYXJOCEOX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	53.14
Topological Polar Surface Area	65.26
Polarizability	21.32
Ring Count	2
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<7 Days	72677-92-0		$1,550.43-$3,335.81$1,550.43$3,335.81