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methyl 4-(4-fluorophenyl)-1H-pyrrole-3-carboxylate

methyl 4-(4-fluorophenyl)-1H-pyrrole-3-carboxylate

Formula: C12H10FNO2

SMILES: COC(=O)C1=CNC=C1C1=CC=C(F)C=C1

IUPAC: methyl 4-(4-fluorophenyl)-1H-pyrrole-3-carboxylate

InChI: InChI=1S/C12H10FNO2/c1-16-12(15)11-7-14-6-10(11)8-2-4-9(13)5-3-8/h2-7,14H,1H3

Composition: C (65.75%), H (4.60%), F (8.67%), N (6.39%), O (14.60%)

Molar Mass: 219.215

Atom Count: 26

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 219.069556729
Formal Charge 0
FSP3 0.08
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey GQZYADSUCVLVOO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 58.19
Topological Polar Surface Area 42.09
Polarizability 23.06
Ring Count 2
Rotatable Bond Count 3

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Struchem co.,ltd
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Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C12H10FNO2 $1,600.00-$3,190.00$1,600.00$2,860.00$3,190.00
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