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Home > Nitro Compounds > 113864-35-0
113864-35-0 | 9H-Carbazole, 9-decyl-3-nitro-
CAS No: 113864-35-0 Catalog No: AG0009YA MDL No:
Product Description
Catalog Number:
AG0009YA
Chemical Name:
9H-Carbazole, 9-decyl-3-nitro-
CAS Number:
113864-35-0
Molecular Formula:
C22H28N2O2
Molecular Weight:
352.4699
IUPAC Name:
9-decyl-3-nitrocarbazole
InChI:
InChI=1S/C22H28N2O2/c1-2-3-4-5-6-7-8-11-16-23-21-13-10-9-12-19(21)20-17-18(24(25)26)14-15-22(20)23/h9-10,12-15,17H,2-8,11,16H2,1H3
InChI Key:
PGLYWHJWHDVNGL-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCn1c2ccc(cc2c2c1cccc2)[N+](=O)[O-]
Properties
Complexity:
436
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
352.215g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
352.478g/mol
Monoisotopic Mass:
352.215g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.6
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