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Methyl 5-(4-methylsulfanyl-phenyl)-1-(4-trifluoromethyl-phenyl)-1h-pyrazole-3-carboxylate

CAS No.:
641639-55-6
Catalog Number:
AG00EFF8
Molecular Formula:
Molecular Weight:
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
≥ 96% (HPLC)
1 week
United States
$111
- +
250mg
≥ 96% (HPLC)
1 week
United States
$162
- +
1g
≥ 96% (HPLC)
1 week
United States
$279
- +
Product Description
Catalog Number:
AG00EFF8
Chemical Name:
Methyl 5-(4-methylsulfanyl-phenyl)-1-(4-trifluoromethyl-phenyl)-1h-pyrazole-3-carboxylate
CAS Number:
641639-55-6
MDL Number:
MFCD04973408
IUPAC Name:
methyl 5-(4-methylsulfanylphenyl)-1-[4-(trifluoromethyl)phenyl]pyrazole-3-carboxylate
InChI:
InChI=1S/C19H15F3N2O2S/c1-26-18(25)16-11-17(12-3-9-15(27-2)10-4-12)24(23-16)14-7-5-13(6-8-14)19(20,21)22/h3-11H,1-2H3
InChI Key:
KSGGVVZMQIRRLK-UHFFFAOYSA-N
Properties
Complexity:
504  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
392.081g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
392.396g/mol
Monoisotopic Mass:
392.081g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
69.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1  
Properties