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1858250-92-6 | Methyl 2,3,5-trifluoro-4-(1H-pyrazol-1-yl)benzoate
CAS No: 1858250-92-6 Catalog No: AG01FGQR MDL No:
Product Description
Catalog Number:
AG01FGQR
Chemical Name:
Methyl 2,3,5-trifluoro-4-(1H-pyrazol-1-yl)benzoate
CAS Number:
1858250-92-6
IUPAC Name:
methyl 2,3,5-trifluoro-4-pyrazol-1-ylbenzoate
InChI:
InChI=1S/C11H7F3N2O2/c1-18-11(17)6-5-7(12)10(9(14)8(6)13)16-4-2-3-15-16/h2-5H,1H3
InChI Key:
LDSPDUMKCQNIBW-UHFFFAOYSA-N
Properties
Complexity:
319
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.046g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.184g/mol
Monoisotopic Mass:
256.046g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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