7-[1-(2,6-dichlorophenoxy)ethyl]-[1,2,4]triazolo[1,5-a]pyrimidine

7-[1-(2,6-dichlorophenoxy)ethyl]-[1,2,4]triazolo[1,5-a]pyrimidine

CAS: 477865-67-1

Formula: C13H10Cl2N4O

SMILES: CC(OC1=C(Cl)C=CC=C1Cl)C1=CC=NC2=NC=NN12

IUPAC: 7-[1-(2,6-dichlorophenoxy)ethyl]-[1,2,4]triazolo[1,5-a]pyrimidine

InChI: InChI=1/C13H10Cl2N4O/c1-8(20-12-9(14)3-2-4-10(12)15)11-5-6-16-13-17-7-18-19(11)13/h2-8H,1H3

Composition: C (50.51%), H (3.26%), Cl (22.93%), N (18.12%), O (5.18%)

Molar Mass: 309.15

Atom Count: 30

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	1
Exact Mass	308.0231664
Formal Charge	0
FSP3	0.15
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	KQQQYNPEJRVKFN-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	88.59
Topological Polar Surface Area	52.31
Polarizability	29.32
Ring Count	3
Rotatable Bond Count	3

Suppliers

Key Organics Ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	477865-67-1		$51.35-$86.31$51.35$63.37$86.31