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89648-38-4 | Phenol, 2-[(4,5-dichloro-2-hydroxyphenyl)azo]-3,4,6-trimethyl-
CAS No: 89648-38-4 Catalog No: AG003VH9 MDL No:
Product Description
Catalog Number:
AG003VH9
Chemical Name:
Phenol, 2-[(4,5-dichloro-2-hydroxyphenyl)azo]-3,4,6-trimethyl-
CAS Number:
89648-38-4
Molecular Formula:
C15H14Cl2N2O2
Molecular Weight:
325.1899
IUPAC Name:
2-[(4,5-dichloro-2-hydroxyphenyl)diazenyl]-3,4,6-trimethylphenol
InChI:
InChI=1S/C15H14Cl2N2O2/c1-7-4-8(2)15(21)14(9(7)3)19-18-12-5-10(16)11(17)6-13(12)20/h4-6,20-21H,1-3H3
InChI Key:
WCLFBOWENSEMOW-UHFFFAOYSA-N
SMILES:
Oc1cc(Cl)c(cc1N=Nc1c(C)c(C)cc(c1O)C)Cl
Properties
Complexity:
383
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.043g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
325.189g/mol
Monoisotopic Mass:
324.043g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
65.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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