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1245643-49-5

1245643-49-5 | 6-(Trifluoromethyl)pyridazine-3-carbaldehyde

CAS No: 1245643-49-5 Catalog No: AG000M84 MDL No:MFCD18072598

Product Description

Catalog Number:
AG000M84
Chemical Name:
6-(Trifluoromethyl)pyridazine-3-carbaldehyde
CAS Number:
1245643-49-5
Molecular Formula:
C6H3F3N2O
Molecular Weight:
176.0960
MDL Number:
MFCD18072598
IUPAC Name:
6-(trifluoromethyl)pyridazine-3-carbaldehyde
InChI:
InChI=1S/C6H3F3N2O/c7-6(8,9)5-2-1-4(3-12)10-11-5/h1-3H
InChI Key:
DJEWMKQZOIZESF-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(nn1)C(F)(F)F

Properties

Complexity:
171  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.02g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.098g/mol
Monoisotopic Mass:
176.02g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
42.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  

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