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Home > Nitro Compounds > 89705-29-3
89705-29-3 | 9(10H)-Acridinone, 2-methyl-1-nitro-
CAS No: 89705-29-3 Catalog No: AG0042OX MDL No:
Product Description
Catalog Number:
AG0042OX
Chemical Name:
9(10H)-Acridinone, 2-methyl-1-nitro-
CAS Number:
89705-29-3
Molecular Formula:
C14H10N2O3
Molecular Weight:
254.2408
IUPAC Name:
2-methyl-1-nitro-10H-acridin-9-one
InChI:
InChI=1S/C14H10N2O3/c1-8-6-7-11-12(13(8)16(18)19)14(17)9-4-2-3-5-10(9)15-11/h2-7H,1H3,(H,15,17)
InChI Key:
IFMOUFFQROBLOJ-UHFFFAOYSA-N
SMILES:
O=c1c2c(ccc(c2[N+](=O)[O-])C)[nH]c2c1cccc2
Properties
Complexity:
393
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.069g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
254.245g/mol
Monoisotopic Mass:
254.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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