methyl 4-fluoro-1H-indole-5-carboxylate

methyl 4-fluoro-1H-indole-5-carboxylate

CAS: 1252782-43-6

Formula: C10H8FNO2

SMILES: COC(=O)C1=CC=C2NC=CC2=C1F

IUPAC: methyl 4-fluoro-1H-indole-5-carboxylate

InChI: InChI=1S/C10H8FNO2/c1-14-10(13)7-2-3-8-6(9(7)11)4-5-12-8/h2-5,12H,1H3

Composition: C (62.18%), H (4.17%), F (9.83%), N (7.25%), O (16.56%)

Molar Mass: 193.177

Atom Count: 22

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	193.053906665
Formal Charge	0
FSP3	0.1
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	XMAMXSQVTKMOPG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	49.39
Topological Polar Surface Area	42.09
Polarizability	19.62
Ring Count	2
Rotatable Bond Count	2

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