5-(4-chlorophenyl)-2-(2,5-dichlorophenoxy)pyrimidine

5-(4-chlorophenyl)-2-(2,5-dichlorophenoxy)pyrimidine

CAS: 477890-46-3

Formula: C16H9Cl3N2O

SMILES: ClC1=CC=C(C=C1)C1=CN=C(OC2=C(Cl)C=CC(Cl)=C2)N=C1

IUPAC: 5-(4-chlorophenyl)-2-(2,5-dichlorophenoxy)pyrimidine

InChI: InChI=1S/C16H9Cl3N2O/c17-12-3-1-10(2-4-12)11-8-20-16(21-9-11)22-15-7-13(18)5-6-14(15)19/h1-9H

Composition: C (54.66%), H (2.58%), Cl (30.25%), N (7.97%), O (4.55%)

Molar Mass: 351.61

Atom Count: 31

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	349.978046
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	WHNQOSAVRFGEMK-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	88.46
Topological Polar Surface Area	35.01
Polarizability	35.44
Ring Count	3
Rotatable Bond Count	3

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90%	<2 Days	477890-46-3		$51.35-$86.31$51.35$63.37$86.31