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Home > Nitro Compounds > 144280-20-6
144280-20-6 | Phenol, 2-[2-(2-nitrophenyl)diazenyl]-4-octyl-
CAS No: 144280-20-6 Catalog No: AG001J8C MDL No:
Product Description
Catalog Number:
AG001J8C
Chemical Name:
Phenol, 2-[2-(2-nitrophenyl)diazenyl]-4-octyl-
CAS Number:
144280-20-6
Molecular Formula:
C20H25N3O3
Molecular Weight:
355.4308
IUPAC Name:
2-[(2-nitrophenyl)diazenyl]-4-octylphenol
InChI:
InChI=1S/C20H25N3O3/c1-2-3-4-5-6-7-10-16-13-14-20(24)18(15-16)22-21-17-11-8-9-12-19(17)23(25)26/h8-9,11-15,24H,2-7,10H2,1H3
InChI Key:
ZRDDPKPUFHRKPC-UHFFFAOYSA-N
SMILES:
CCCCCCCCc1ccc(c(c1)N=Nc1ccccc1[N+](=O)[O-])O
Properties
Complexity:
439
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
355.19g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
355.438g/mol
Monoisotopic Mass:
355.19g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
90.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.2
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