ethyl 6-chloro-1H-pyrrolo[2,3-b]pyridine-2-carboxylate

ethyl 6-chloro-1H-pyrrolo[2,3-b]pyridine-2-carboxylate

CAS: 287384-84-3

Formula: C10H9ClN2O2

SMILES: CCOC(=O)C1=CC2=CC=C(Cl)N=C2N1

IUPAC: ethyl 6-chloro-1H-pyrrolo[2,3-b]pyridine-2-carboxylate

InChI: InChI=1S/C10H9ClN2O2/c1-2-15-10(14)7-5-6-3-4-8(11)13-9(6)12-7/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	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	DLOFYLZHQBTQQA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.46
Topological Polar Surface Area	54.98
Polarizability	22.21
Ring Count	2
Rotatable Bond Count	3

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