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872102-12-0 | 3-Pyridazinamine, 6-chloro-N-[(4-fluorophenyl)methyl]-
CAS No: 872102-12-0 Catalog No: AG004JEF MDL No:MFCD07681959
Product Description
Catalog Number:
AG004JEF
Chemical Name:
3-Pyridazinamine, 6-chloro-N-[(4-fluorophenyl)methyl]-
CAS Number:
872102-12-0
Molecular Formula:
C11H9ClFN3
Molecular Weight:
237.6607
MDL Number:
MFCD07681959
IUPAC Name:
6-chloro-N-[(4-fluorophenyl)methyl]pyridazin-3-amine
InChI:
InChI=1S/C11H9ClFN3/c12-10-5-6-11(16-15-10)14-7-8-1-3-9(13)4-2-8/h1-6H,7H2,(H,14,16)
InChI Key:
KSLVFCHUZQYJNF-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)CNc1ccc(nn1)Cl
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.047g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
237.662g/mol
Monoisotopic Mass:
237.047g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
37.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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