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Home > Aldehydes > 175202-93-4
175202-93-4 | 2-Thiophenecarboxaldehyde, 5-[1-methyl-5-(trifluoromethyl)-1H-pyrazol-3-yl]-
CAS No: 175202-93-4 Catalog No: AG0020HM MDL No:MFCD00052163
Product Description
Catalog Number:
AG0020HM
Chemical Name:
2-Thiophenecarboxaldehyde, 5-[1-methyl-5-(trifluoromethyl)-1H-pyrazol-3-yl]-
CAS Number:
175202-93-4
Molecular Formula:
C10H7F3N2OS
Molecular Weight:
260.2356
MDL Number:
MFCD00052163
IUPAC Name:
5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carbaldehyde
InChI:
InChI=1S/C10H7F3N2OS/c1-15-9(10(11,12)13)4-7(14-15)8-3-2-6(5-16)17-8/h2-5H,1H3
InChI Key:
ITUYPRXQRPMRTL-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(s1)c1nn(c(c1)C(F)(F)F)C
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.023g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.234g/mol
Monoisotopic Mass:
260.023g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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