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methyl 4-fluoro-1H-indole-7-carboxylate

methyl 4-fluoro-1H-indole-7-carboxylate

CAS: 313337-35-8

Formula: C10H8FNO2

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

IUPAC: methyl 4-fluoro-1H-indole-7-carboxylate

InChI: InChI=1S/C10H8FNO2/c1-14-10(13)7-2-3-8(11)6-4-5-12-9(6)7/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 HEQXLRSGYSDTAZ-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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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 313337-35-8 $295.07-$5,182.71$295.07$335.43$1,036.54$1,727.57$3,455.14$5,182.71
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