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Home > Other Heterocycles > 88365-98-4
88365-98-4 | 1,2-Diazabicyclo[5.2.0]nona-2,4-dien-9-one, 5-methyl-
CAS No: 88365-98-4 Catalog No: AG004G1H MDL No:
Product Description
Catalog Number:
AG004G1H
Chemical Name:
1,2-Diazabicyclo[5.2.0]nona-2,4-dien-9-one, 5-methyl-
CAS Number:
88365-98-4
Molecular Formula:
C8H10N2O
Molecular Weight:
150.1778
IUPAC Name:
5-methyl-1,2-diazabicyclo[5.2.0]nona-2,4-dien-9-one
InChI:
InChI=1S/C8H10N2O/c1-6-2-3-9-10-7(4-6)5-8(10)11/h2-3,7H,4-5H2,1H3
InChI Key:
ZFFIEXLDSYSREA-UHFFFAOYSA-N
SMILES:
CC1=CC=NN2C(C1)CC2=O
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.079g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
150.181g/mol
Monoisotopic Mass:
150.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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