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28657-39-8 | Pyridazine, 3-chloro-4-methyl-6-phenyl-
CAS No: 28657-39-8 Catalog No: AG002VZL MDL No:MFCD09907697
Product Description
Catalog Number:
AG002VZL
Chemical Name:
Pyridazine, 3-chloro-4-methyl-6-phenyl-
CAS Number:
28657-39-8
Molecular Formula:
C11H9ClN2
Molecular Weight:
204.6556
MDL Number:
MFCD09907697
IUPAC Name:
3-chloro-4-methyl-6-phenylpyridazine
InChI:
InChI=1S/C11H9ClN2/c1-8-7-10(13-14-11(8)12)9-5-3-2-4-6-9/h2-7H,1H3
InChI Key:
ROVPWRBPJHXFRE-UHFFFAOYSA-N
SMILES:
Cc1cc(nnc1Cl)c1ccccc1
EC Number:
249-130-1
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.045g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.657g/mol
Monoisotopic Mass:
204.045g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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