6-(trifluoromethyl)quinazoline-4-carbonitrile

6-(trifluoromethyl)quinazoline-4-carbonitrile

CAS: 2113866-08-1

Formula: C10H4F3N3

SMILES: FC(F)(F)C1=CC=C2N=CN=C(C#N)C2=C1

IUPAC: 6-(trifluoromethyl)quinazoline-4-carbonitrile

InChI: InChI=1S/C10H4F3N3/c11-10(12,13)6-1-2-8-7(3-6)9(4-14)16-5-15-8/h1-3,5H

Composition: C (53.82%), H (1.81%), F (25.54%), N (18.83%)

Molar Mass: 223.158

Atom Count: 20

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	223.03573163
Formal Charge	0
FSP3	0.1
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	VIPQZQXOJNKGLW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.12
Topological Polar Surface Area	49.57
Polarizability	18.98
Ring Count	2
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	2113866-08-1		$92.05-$459.00$92.05$184.11$306.42$459.00