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1-(3-fluoro-4-methoxyphenyl)-3-(1,3-thiazol-2-yl)propan-1-one

1-(3-fluoro-4-methoxyphenyl)-3-(1,3-thiazol-2-yl)propan-1-one

Formula: C13H12FNO2S

SMILES: COC1=C(F)C=C(C=C1)C(=O)CCC1=NC=CS1

IUPAC: 1-(3-fluoro-4-methoxyphenyl)-3-(1,3-thiazol-2-yl)propan-1-one

InChI: InChI=1S/C13H12FNO2S/c1-17-12-4-2-9(8-10(12)14)11(16)3-5-13-15-6-7-18-13/h2,4,6-8H,3,5H2,1H3

Composition: C (58.85%), H (4.56%), F (7.16%), N (5.28%), O (12.06%), S (12.08%)

Molar Mass: 265.3

Atom Count: 30

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 265.057277967
Formal Charge 0
FSP3 0.23
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey OTIVVPJNPFTTNX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 67.1
Topological Polar Surface Area 39.19
Polarizability 25.52
Ring Count 2
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Struchem co.,ltd
Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C13H12FNO2S $1,301.00-$2,420.00$1,301.00$1,901.00$2,420.00
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