methyl 6-methoxy-1H-indole-3-carboxylate

methyl 6-methoxy-1H-indole-3-carboxylate

CAS: 131424-27-6

Formula: C11H11NO3

SMILES: COC(=O)C1=CNC2=CC(OC)=CC=C12

IUPAC: methyl 6-methoxy-1H-indole-3-carboxylate

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