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Home Other Building Blocks (5-(4-Chlorophenoxy)-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl)methanol

(5-(4-Chlorophenoxy)-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl)methanol

CAS No.:
318239-67-7
Catalog Number:
AG00CK23
Molecular Formula:
C12H10ClF3N2O2
Molecular Weight:
306.6682
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
1 week
United States
$225
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Product Description
Catalog Number:
AG00CK23
Chemical Name:
(5-(4-Chlorophenoxy)-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl)methanol
CAS Number:
318239-67-7
Molecular Formula:
C12H10ClF3N2O2
Molecular Weight:
306.6682
MDL Number:
MFCD00172650
IUPAC Name:
[5-(4-chlorophenoxy)-1-methyl-3-(trifluoromethyl)pyrazol-4-yl]methanol
InChI:
InChI=1S/C12H10ClF3N2O2/c1-18-11(20-8-4-2-7(13)3-5-8)9(6-19)10(17-18)12(14,15)16/h2-5,19H,6H2,1H3
InChI Key:
DIVFCQKXUCIGKZ-UHFFFAOYSA-N
SMILES:
OCc1c(Oc2ccc(cc2)Cl)n(nc1C(F)(F)F)C
Properties
Complexity:
324  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.038g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
306.669g/mol
Monoisotopic Mass:
306.038g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
47.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties