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27801-08-7 | 2-Naphthalenecarboxylic acid, 4-[2-(6-chloro-1H-indazol-3-yl)diazenyl]-3-hydroxy-
CAS No: 27801-08-7 Catalog No: AG002USQ MDL No:
Product Description
Catalog Number:
AG002USQ
Chemical Name:
2-Naphthalenecarboxylic acid, 4-[2-(6-chloro-1H-indazol-3-yl)diazenyl]-3-hydroxy-
CAS Number:
27801-08-7
Molecular Formula:
C18H11ClN4O3
Molecular Weight:
366.7579
IUPAC Name:
4-[(6-chloro-1H-indazol-3-yl)diazenyl]-3-hydroxynaphthalene-2-carboxylic acid
InChI:
InChI=1S/C18H11ClN4O3/c19-10-5-6-12-14(8-10)20-22-17(12)23-21-15-11-4-2-1-3-9(11)7-13(16(15)24)18(25)26/h1-8,24H,(H,20,22)(H,25,26)
InChI Key:
RHZLGRLIRRXWAU-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)[nH]nc2N=Nc1c(O)c(cc2c1cccc2)C(=O)O
Properties
Complexity:
563
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
366.052g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
366.761g/mol
Monoisotopic Mass:
366.052g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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