2,5-dichloro-8-methylquinoline-3-carbonitrile

2,5-dichloro-8-methylquinoline-3-carbonitrile

CAS: 948291-30-3

Formula: C11H6Cl2N2

SMILES: CC1=C2N=C(Cl)C(=CC2=C(Cl)C=C1)C#N

IUPAC: 2,5-dichloro-8-methylquinoline-3-carbonitrile

InChI: InChI=1S/C11H6Cl2N2/c1-6-2-3-9(12)8-4-7(5-14)11(13)15-10(6)8/h2-4H,1H3

Composition: C (55.73%), H (2.55%), Cl (29.91%), N (11.82%)

Molar Mass: 237.08

Atom Count: 21

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	235.9908036
Formal Charge	0
FSP3	0.09
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	PMBFJSVYRZPMFI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	61.41
Topological Polar Surface Area	36.68
Polarizability	24.35
Ring Count	2
Rotatable Bond Count	0

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<7 Days	948291-30-3		$113.85-$3,050.15$113.85$185.27$312.57$589.95$970.83$1,589.76$3,050.15