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87700-48-9 | Cyclobuta[c]quinolin-3(1H)-one, 2,4-dihydro-4-methyl-1-methylene-
CAS No: 87700-48-9 Catalog No: AG004NCO MDL No:
Product Description
Catalog Number:
AG004NCO
Chemical Name:
Cyclobuta[c]quinolin-3(1H)-one, 2,4-dihydro-4-methyl-1-methylene-
CAS Number:
87700-48-9
Molecular Formula:
C13H11NO
Molecular Weight:
197.2325
IUPAC Name:
4-methyl-1-methylidene-2H-cyclobuta[c]quinolin-3-one
InChI:
InChI=1S/C13H11NO/c1-8-7-10-12(8)9-5-3-4-6-11(9)14(2)13(10)15/h3-6H,1,7H2,2H3
InChI Key:
RLYMPDWQDMPZMI-UHFFFAOYSA-N
SMILES:
C=C1Cc2c1c1ccccc1n(c2=O)C
Properties
Complexity:
380
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.084g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.237g/mol
Monoisotopic Mass:
197.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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