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Home > Nitro Compounds > 125836-07-9
125836-07-9 | 3-nitroquinolin-4(1H)-one
CAS No: 125836-07-9 Catalog No: AG00J79F MDL No:MFCD01820324
Product Description
Catalog Number:
AG00J79F
Chemical Name:
3-nitroquinolin-4(1H)-one
CAS Number:
125836-07-9
Molecular Formula:
C9H6N2O3
Molecular Weight:
190.1555
MDL Number:
MFCD01820324
IUPAC Name:
3-nitro-1H-quinolin-4-one
InChI:
InChI=1S/C9H6N2O3/c12-9-6-3-1-2-4-7(6)10-5-8(9)11(13)14/h1-5H,(H,10,12)
InChI Key:
ZWISCKSGNCMAQO-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c[nH]c2c(c1=O)cccc2
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.038g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.158g/mol
Monoisotopic Mass:
190.038g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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