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methyl 6-methoxy-1H-indole-5-carboxylate

methyl 6-methoxy-1H-indole-5-carboxylate

CAS: 251107-30-9

Formula: C11H11NO3

SMILES: COC(=O)C1=C(OC)C=C2NC=CC2=C1

IUPAC: methyl 6-methoxy-1H-indole-5-carboxylate

InChI: InChI=1S/C11H11NO3/c1-14-10-6-9-7(3-4-12-9)5-8(10)11(13)15-2/h3-6,12H,1-2H3

Composition: C (64.38%), H (5.40%), N (6.83%), O (23.39%)

Molar Mass: 205.213

Atom Count: 26

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 205.073893218
Formal Charge 0
FSP3 0.18
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey OXVBFGGHYOUQIM-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 55.63
Topological Polar Surface Area 51.32
Polarizability 22.47
Ring Count 2
Rotatable Bond Count 3

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