ethyl 6-chloro-1H-indazole-3-carboxylate

ethyl 6-chloro-1H-indazole-3-carboxylate

CAS: 885279-23-2

Formula: C10H9ClN2O2

SMILES: CCOC(=O)C1=NNC2=CC(Cl)=CC=C12

IUPAC: ethyl 6-chloro-1H-indazole-3-carboxylate

InChI: InChI=1S/C10H9ClN2O2/c1-2-15-10(14)9-7-4-3-6(11)5-8(7)12-13-9/h3-5H,2H2,1H3,(H,12,13)

Composition: C (53.47%), H (4.04%), Cl (15.78%), N (12.47%), O (14.24%)

Molar Mass: 224.64

Atom Count: 24

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	224.0352552
Formal Charge	0
FSP3	0.2
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	ODNWYEBPQBUTHM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.28
Topological Polar Surface Area	54.98
Polarizability	22.8
Ring Count	2
Rotatable Bond Count	3

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