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Home > Aldehydes > 1432681-54-3
1432681-54-3 | 1-(difluoromethyl)-1H-pyrazole-3-carbaldehyde
CAS No: 1432681-54-3 Catalog No: AG01A4LC MDL No:MFCD24369110
Product Description
Catalog Number:
AG01A4LC
Chemical Name:
1-(difluoromethyl)-1H-pyrazole-3-carbaldehyde
CAS Number:
1432681-54-3
Molecular Formula:
C5H4F2N2O
Molecular Weight:
146.0949
MDL Number:
MFCD24369110
IUPAC Name:
1-(difluoromethyl)pyrazole-3-carbaldehyde
InChI:
InChI=1S/C5H4F2N2O/c6-5(7)9-2-1-4(3-10)8-9/h1-3,5H
InChI Key:
ATWIFXNYFADQFA-UHFFFAOYSA-N
SMILES:
O=Cc1ccn(n1)C(F)F
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.029g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
146.097g/mol
Monoisotopic Mass:
146.029g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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