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{4-methyl-2-[3-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}methanol

{4-methyl-2-[3-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}methanol

CAS: 668477-94-9

Formula: C12H10F3NOS

SMILES: CC1=C(CO)SC(=N1)C1=CC(=CC=C1)C(F)(F)F

IUPAC: {4-methyl-2-[3-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}methanol

InChI: InChI=1S/C12H10F3NOS/c1-7-10(6-17)18-11(16-7)8-3-2-4-9(5-8)12(13,14)15/h2-5,17H,6H2,1H3

Composition: C (52.74%), H (3.69%), F (20.86%), N (5.13%), O (5.85%), S (11.73%)

Molar Mass: 273.27

Atom Count: 28

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 273.043519609
Formal Charge 0
FSP3 0.25
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey JUQXNDWKZOIZPS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 73.53
Topological Polar Surface Area 33.12
Polarizability 23.73
Ring Count 2
Rotatable Bond Count 3

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Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 668477-94-9 $51.35-$1,347.05$51.35$63.37$86.31$292.79$449.02$1,347.05
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