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116228-40-1 | 4-iodo-1-tosyl-1H-pyrazole
CAS No: 116228-40-1 Catalog No: AG01DDR3 MDL No:MFCD27998250
Product Description
Catalog Number:
AG01DDR3
Chemical Name:
4-iodo-1-tosyl-1H-pyrazole
CAS Number:
116228-40-1
MDL Number:
MFCD27998250
IUPAC Name:
4-iodo-1-(4-methylphenyl)sulfonylpyrazole
InChI:
InChI=1S/C10H9IN2O2S/c1-8-2-4-10(5-3-8)16(14,15)13-7-9(11)6-12-13/h2-7H,1H3
InChI Key:
ZUPAEJKALBCZFM-UHFFFAOYSA-N
Properties
Complexity:
333
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
347.943g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
348.158g/mol
Monoisotopic Mass:
347.943g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
60.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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