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Home > Aldehydes > 1443279-59-1
1443279-59-1 | 2-ETHYL-5-TRIFLUOROMETHYL-2H-PYRAZOLE-3-CARBALDEHYDE
CAS No: 1443279-59-1 Catalog No: AG01DW1W MDL No:MFCD25368865
Product Description
Catalog Number:
AG01DW1W
Chemical Name:
2-ETHYL-5-TRIFLUOROMETHYL-2H-PYRAZOLE-3-CARBALDEHYDE
CAS Number:
1443279-59-1
Molecular Formula:
C7H7F3N2O
Molecular Weight:
192.1385
MDL Number:
MFCD25368865
IUPAC Name:
2-ethyl-5-(trifluoromethyl)pyrazole-3-carbaldehyde
InChI:
InChI=1S/C7H7F3N2O/c1-2-12-5(4-13)3-6(11-12)7(8,9)10/h3-4H,2H2,1H3
InChI Key:
ZSWKBVVPDPLSRV-UHFFFAOYSA-N
SMILES:
O=Cc1cc(nn1CC)C(F)(F)F
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.051g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.141g/mol
Monoisotopic Mass:
192.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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