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69943-66-4 | trisodium [3-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]-2-hydroxy-5-nitrobenzenesulphonato(3-)][2-hydroxy-3-[(2-hydroxy-1-naphthyl)azo]-5-nitrobenzenesulphonato(3-)]chromate(3-)
CAS No: 69943-66-4 Catalog No: AG00G1DH MDL No:
Product Description
Catalog Number:
AG00G1DH
Chemical Name:
trisodium [3-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]-2-hydroxy-5-nitrobenzenesulphonato(3-)][2-hydroxy-3-[(2-hydroxy-1-naphthyl)azo]-5-nitrobenzenesulphonato(3-)]chromate(3-)
CAS Number:
69943-66-4
IUPAC Name:
trisodium;chromium;2-hydroxy-3-[(2-hydroxynaphthalen-1-yl)diazenyl]-5-nitrobenzenesulfonic acid;2-hydroxy-3-[(3-methyl-5-oxo-1-phenylpyrazol-4-id-4-yl)diazenyl]-5-nitrobenzenesulfonic acid
InChI:
InChI=1S/C16H12N5O7S.C16H11N3O7S.Cr.3Na/c1-9-14(16(23)20(19-9)10-5-3-2-4-6-10)18-17-12-7-11(21(24)25)8-13(15(12)22)29(26,27)28;20-13-6-5-9-3-1-2-4-11(9)15(13)18-17-12-7-10(19(22)23)8-14(16(12)21)27(24,25)26;;;;/h2-8,22H,1H3,(H,26,27,28);1-8,20-21H,(H,24,25,26);;;;/q-1;;;3*+1
InChI Key:
XVWBNGOGVYTHSE-UHFFFAOYSA-N
EC Number:
274-230-7
Properties
Complexity:
1750
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
6
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
927.987g/mol
Formal Charge:
2
Heavy Atom Count:
60
Hydrogen Bond Acceptor Count:
20
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
928.663g/mol
Monoisotopic Mass:
927.987g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
360A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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