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methyl 1H-pyrrolo[2,3-c]pyridine-7-carboxylate

methyl 1H-pyrrolo[2,3-c]pyridine-7-carboxylate

CAS: 945840-73-3

Formula: C9H8N2O2

SMILES: COC(=O)C1=C2NC=CC2=CC=N1

IUPAC: methyl 1H-pyrrolo[2,3-c]pyridine-7-carboxylate

InChI: InChI=1S/C9H8N2O2/c1-13-9(12)8-7-6(2-4-10-7)3-5-11-8/h2-5,10H,1H3

Composition: C (61.36%), H (4.58%), N (15.90%), O (18.16%)

Molar Mass: 176.175

Atom Count: 21

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 176.058577506
Formal Charge 0
FSP3 0.11
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey CBVIMPIFKLOXDL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 46.64
Topological Polar Surface Area 54.98
Polarizability 19.08
Ring Count 2
Rotatable Bond Count 2

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97% <7 Days 945840-73-3 $266.48-$2,102.82$266.48$335.67$516.12$742.39$2,102.82
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