8-methoxyisoquinoline-4-carbonitrile

8-methoxyisoquinoline-4-carbonitrile

Formula: C11H8N2O

SMILES: COC1=CC=CC2=C(C=NC=C12)C#N

IUPAC: 8-methoxyisoquinoline-4-carbonitrile

InChI: InChI=1S/C11H8N2O/c1-14-11-4-2-3-9-8(5-12)6-13-7-10(9)11/h2-4,6-7H,1H3

Composition: C (71.73%), H (4.38%), N (15.21%), O (8.69%)

Molar Mass: 184.198

Atom Count: 22

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	184.063662886
Formal Charge	0
FSP3	0.09
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	BSTXBBSSSOBUEA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.54
Topological Polar Surface Area	45.91
Polarizability	21.31
Ring Count	2
Rotatable Bond Count	1

Suppliers

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C11H8N2O		Quote Only