Home Other Building Blocks 7-fluoro-1-methyl-1,4-dihydrocinnolin-4-one

7-fluoro-1-methyl-1,4-dihydrocinnolin-4-one

CAS No.:
1174644-27-9
Catalog Number:
AG01ALBX
Molecular Formula:
C9H7FN2O
Molecular Weight:
178.1631
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Product Description
Catalog Number:
AG01ALBX
Chemical Name:
7-fluoro-1-methyl-1,4-dihydrocinnolin-4-one
CAS Number:
1174644-27-9
Molecular Formula:
C9H7FN2O
Molecular Weight:
178.1631
MDL Number:
MFCD28954316
IUPAC Name:
7-fluoro-1-methylcinnolin-4-one
InChI:
InChI=1S/C9H7FN2O/c1-12-8-4-6(10)2-3-7(8)9(13)5-11-12/h2-5H,1H3
InChI Key:
MXTRZUZMIHEUDZ-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)n(C)ncc2=O
Properties
Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.054g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.166g/mol
Monoisotopic Mass:
178.054g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties