ethyl 4-chloropyrrolo[2,1-f][1,2,4]triazine-7-carboxylate

ethyl 4-chloropyrrolo[2,1-f][1,2,4]triazine-7-carboxylate

CAS: 1356016-43-7

Formula: C9H8ClN3O2

SMILES: CCOC(=O)C1=CC=C2N1N=CN=C2Cl

IUPAC: ethyl 4-chloropyrrolo[2,1-f][1,2,4]triazine-7-carboxylate

InChI: InChI=1S/C9H8ClN3O2/c1-2-15-9(14)7-4-3-6-8(10)11-5-12-13(6)7/h3-5H,2H2,1H3

Composition: C (47.91%), H (3.57%), Cl (15.71%), N (18.62%), O (14.18%)

Molar Mass: 225.63

Atom Count: 23

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	225.0305042
Formal Charge	0
FSP3	0.22
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	JWYDJDGPIZQXNN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	67.32
Topological Polar Surface Area	56.49
Polarizability	21.36
Ring Count	2
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	1356016-43-7		$244.63-$1,008.80$244.63$392.17$673.37$1,008.80