Home Halogens 2-[(1-Benzyl-4-chloro-1H-pyrazol-3-yl)oxy]-2-methylpropanoic acid

2-[(1-Benzyl-4-chloro-1H-pyrazol-3-yl)oxy]-2-methylpropanoic acid

CAS No.:
68429-96-9
Catalog Number:
AG01EWY7
Molecular Formula:
C14H15ClN2O3
Molecular Weight:
294.7335
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
97%
1 week
United States
$469
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Product Description
Catalog Number:
AG01EWY7
Chemical Name:
2-[(1-Benzyl-4-chloro-1H-pyrazol-3-yl)oxy]-2-methylpropanoic acid
CAS Number:
68429-96-9
Molecular Formula:
C14H15ClN2O3
Molecular Weight:
294.7335
MDL Number:
MFCD00966913
IUPAC Name:
2-(1-benzyl-4-chloropyrazol-3-yl)oxy-2-methylpropanoic acid
InChI:
InChI=1S/C14H15ClN2O3/c1-14(2,13(18)19)20-12-11(15)9-17(16-12)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,18,19)
InChI Key:
SRLZTCYHXUZBCU-UHFFFAOYSA-N
SMILES:
OC(=O)C(Oc1nn(cc1Cl)Cc1ccccc1)(C)C
Properties
Complexity:
345  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.077g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
294.735g/mol
Monoisotopic Mass:
294.077g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties