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144558-83-8 | 1,3-Naphthalenediol, 4-[2-(3,5-dibromo-2-pyridinyl)diazenyl]-
CAS No: 144558-83-8 Catalog No: AG001JQF MDL No:
Product Description
Catalog Number:
AG001JQF
Chemical Name:
1,3-Naphthalenediol, 4-[2-(3,5-dibromo-2-pyridinyl)diazenyl]-
CAS Number:
144558-83-8
Molecular Formula:
C15H9Br2N3O2
Molecular Weight:
423.0589
IUPAC Name:
4-[(3,5-dibromopyridin-2-yl)diazenyl]naphthalene-1,3-diol
InChI:
InChI=1S/C15H9Br2N3O2/c16-8-5-11(17)15(18-7-8)20-19-14-10-4-2-1-3-9(10)12(21)6-13(14)22/h1-7,21-22H
InChI Key:
NTQCGAPWMSEFEE-UHFFFAOYSA-N
SMILES:
Brc1cnc(c(c1)Br)N=Nc1c(O)cc(c2c1cccc2)O
Properties
Complexity:
412
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
422.904g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
423.064g/mol
Monoisotopic Mass:
420.906g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
78.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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