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methyl 6-chloro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate

methyl 6-chloro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate

CAS: 1140512-59-9

Formula: C9H7ClN2O2

SMILES: COC(=O)C1=CC2=CN=C(Cl)C=C2N1

IUPAC: methyl 6-chloro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate

InChI: InChI=1S/C9H7ClN2O2/c1-14-9(13)7-2-5-4-11-8(10)3-6(5)12-7/h2-4,12H,1H3

Composition: C (51.32%), H (3.35%), Cl (16.83%), N (13.30%), O (15.19%)

Molar Mass: 210.62

Atom Count: 21

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 210.0196052
Formal Charge 0
FSP3 0.11
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey BODVKIYHCWAOBK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 52.76
Topological Polar Surface Area 54.98
Polarizability 21.02
Ring Count 2
Rotatable Bond Count 2

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