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72375-53-2 | Phenol, 5-(diethylamino)-2-[(4-nitrophenyl)azo]-
CAS No: 72375-53-2 Catalog No: AG005HZB MDL No:
Product Description
Catalog Number:
AG005HZB
Chemical Name:
Phenol, 5-(diethylamino)-2-[(4-nitrophenyl)azo]-
CAS Number:
72375-53-2
Molecular Formula:
C16H18N4O3
Molecular Weight:
314.3391
IUPAC Name:
5-(diethylamino)-2-[(4-nitrophenyl)diazenyl]phenol
InChI:
InChI=1S/C16H18N4O3/c1-3-19(4-2)14-9-10-15(16(21)11-14)18-17-12-5-7-13(8-6-12)20(22)23/h5-11,21H,3-4H2,1-2H3
InChI Key:
ISCOCYKFSSWCOU-UHFFFAOYSA-N
SMILES:
CCN(c1ccc(c(c1)O)N=Nc1ccc(cc1)[N+](=O)[O-])CC
Properties
Complexity:
401
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.138g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
314.345g/mol
Monoisotopic Mass:
314.138g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
94A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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