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N-{2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]ethyl}-2,2,2-trifluoroacetamide

N-{2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]ethyl}-2,2,2-trifluoroacetamide

Formula: C13H10ClF3N2OS

SMILES: FC(F)(F)C(=O)NCCC1=NC(=CS1)C1=CC=C(Cl)C=C1

IUPAC: N-{2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]ethyl}-2,2,2-trifluoroacetamide

InChI: InChI=1S/C13H10ClF3N2OS/c14-9-3-1-8(2-4-9)10-7-21-11(19-10)5-6-18-12(20)13(15,16)17/h1-4,7H,5-6H2,(H,18,20)

Composition: C (46.65%), H (3.01%), Cl (10.59%), F (17.03%), N (8.37%), O (4.78%), S (9.58%)

Molar Mass: 334.74

Atom Count: 31

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 334.0154463
Formal Charge 0
FSP3 0.23
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey GCMVFOVGEAZTNP-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 73.79
Topological Polar Surface Area 41.99
Polarizability 28.85
Ring Count 2
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C13H10ClF3N2OS $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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