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Home > Nitro Compounds > 675585-23-6
675585-23-6 | 9H-Carbazole, 9-(6-nitrohexyl)-
CAS No: 675585-23-6 Catalog No: AG005MMY MDL No:
Product Description
Catalog Number:
AG005MMY
Chemical Name:
9H-Carbazole, 9-(6-nitrohexyl)-
CAS Number:
675585-23-6
Molecular Formula:
C18H20N2O2
Molecular Weight:
296.3636
IUPAC Name:
9-(6-nitrohexyl)carbazole
InChI:
InChI=1S/C18H20N2O2/c21-20(22)14-8-2-1-7-13-19-17-11-5-3-9-15(17)16-10-4-6-12-18(16)19/h3-6,9-12H,1-2,7-8,13-14H2
InChI Key:
UAYMCYWZJTZOFX-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)CCCCCCn1c2ccccc2c2c1cccc2
Properties
Complexity:
347
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.152g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
296.37g/mol
Monoisotopic Mass:
296.152g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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