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Home > Nitro Compounds > 1150163-86-2
1150163-86-2 | Cyclohexanol, 4-(5-nitro-6-quinolinyl)-
CAS No: 1150163-86-2 Catalog No: AG000FO4 MDL No:MFCD12026011
Product Description
Catalog Number:
AG000FO4
Chemical Name:
Cyclohexanol, 4-(5-nitro-6-quinolinyl)-
CAS Number:
1150163-86-2
Molecular Formula:
C15H16N2O3
Molecular Weight:
272.2991
MDL Number:
MFCD12026011
IUPAC Name:
4-(5-nitroquinolin-6-yl)cyclohexan-1-ol
InChI:
InChI=1S/C15H16N2O3/c18-11-5-3-10(4-6-11)12-7-8-14-13(2-1-9-16-14)15(12)17(19)20/h1-2,7-11,18H,3-6H2
InChI Key:
BNTXCDKSVPDJNE-UHFFFAOYSA-N
SMILES:
OC1CCC(CC1)c1ccc2c(c1[N+](=O)[O-])cccn2
Properties
Complexity:
350
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.116g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
272.304g/mol
Monoisotopic Mass:
272.116g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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