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Home > Nitro Compounds > 28673-36-1
28673-36-1 | Quinoline, 2-methyl-4-nitro-
CAS No: 28673-36-1 Catalog No: AG002W22 MDL No:
Product Description
Catalog Number:
AG002W22
Chemical Name:
Quinoline, 2-methyl-4-nitro-
CAS Number:
28673-36-1
Molecular Formula:
C10H8N2O2
Molecular Weight:
188.1827
IUPAC Name:
2-methyl-4-nitroquinoline
InChI:
InChI=1S/C10H8N2O2/c1-7-6-10(12(13)14)8-4-2-3-5-9(8)11-7/h2-6H,1H3
InChI Key:
VPADYBIJEXXKLO-UHFFFAOYSA-N
SMILES:
Cc1nc2ccccc2c(c1)[N+](=O)[O-]
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.059g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.186g/mol
Monoisotopic Mass:
188.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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