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Home > Fluorides > 1269293-52-8
1269293-52-8 | 1H-Pyrazole, 5-(dimethoxymethyl)-1-(4-fluorophenyl)-
CAS No: 1269293-52-8 Catalog No: AG000WD7 MDL No:MFCD20275370
Product Description
Catalog Number:
AG000WD7
Chemical Name:
1H-Pyrazole, 5-(dimethoxymethyl)-1-(4-fluorophenyl)-
CAS Number:
1269293-52-8
Molecular Formula:
C12H13FN2O2
Molecular Weight:
236.2422
MDL Number:
MFCD20275370
IUPAC Name:
5-(dimethoxymethyl)-1-(4-fluorophenyl)pyrazole
InChI:
InChI=1S/C12H13FN2O2/c1-16-12(17-2)11-7-8-14-15(11)10-5-3-9(13)4-6-10/h3-8,12H,1-2H3
InChI Key:
JFXNGDOZWMUVMI-UHFFFAOYSA-N
SMILES:
COC(c1ccnn1c1ccc(cc1)F)OC
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.096g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.246g/mol
Monoisotopic Mass:
236.096g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
36.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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