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82280-65-7 | Phenol, 2-[(3,5-dibromo-2-pyridinyl)azo]-5-(dimethylamino)-
CAS No: 82280-65-7 Catalog No: AG004ZZY MDL No:
Product Description
Catalog Number:
AG004ZZY
Chemical Name:
Phenol, 2-[(3,5-dibromo-2-pyridinyl)azo]-5-(dimethylamino)-
CAS Number:
82280-65-7
Molecular Formula:
C13H12Br2N4O
Molecular Weight:
400.0686
IUPAC Name:
2-[(3,5-dibromopyridin-2-yl)diazenyl]-5-(dimethylamino)phenol
InChI:
InChI=1S/C13H12Br2N4O/c1-19(2)9-3-4-11(12(20)6-9)17-18-13-10(15)5-8(14)7-16-13/h3-7,20H,1-2H3
InChI Key:
OOGIYHBZUSZFIC-UHFFFAOYSA-N
SMILES:
Brc1cnc(c(c1)Br)N=Nc1ccc(cc1O)N(C)C
Properties
Complexity:
342
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
399.936g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
400.074g/mol
Monoisotopic Mass:
397.938g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
61.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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