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Home > Nitro Compounds > 90771-17-8
90771-17-8 | 4-METHYL-6-NITRO-QUINOLIN-2-OL
CAS No: 90771-17-8 Catalog No: AG00H1X2 MDL No:MFCD01014320
Product Description
Catalog Number:
AG00H1X2
Chemical Name:
4-METHYL-6-NITRO-QUINOLIN-2-OL
CAS Number:
90771-17-8
Molecular Formula:
C10H8N2O3
Molecular Weight:
204.1821
MDL Number:
MFCD01014320
IUPAC Name:
4-methyl-6-nitro-1H-quinolin-2-one
InChI:
InChI=1S/C10H8N2O3/c1-6-4-10(13)11-9-3-2-7(12(14)15)5-8(6)9/h2-5H,1H3,(H,11,13)
InChI Key:
QBBNQTCDZWMPAH-UHFFFAOYSA-N
SMILES:
Oc1cc(C)c2c(n1)ccc(c2)[N+](=O)[O-]
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.053g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.185g/mol
Monoisotopic Mass:
204.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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