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4430-18-6 | ACID VIOLET 43
CAS No: 4430-18-6 Catalog No: AG003NOL MDL No:MFCD00068446
Product Description
Catalog Number:
AG003NOL
Chemical Name:
ACID VIOLET 43
CAS Number:
4430-18-6
MDL Number:
MFCD00068446
IUPAC Name:
sodium;2-[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]-5-methylbenzenesulfonate
InChI:
InChI=1S/C21H15NO6S.Na/c1-11-6-7-14(17(10-11)29(26,27)28)22-15-8-9-16(23)19-18(15)20(24)12-4-2-3-5-13(12)21(19)25;/h2-10,22-23H,1H3,(H,26,27,28);/q;+1/p-1
InChI Key:
GTKIEPUIFBBXJQ-UHFFFAOYSA-M
EC Number:
224-618-7
UNII:
G5UX3K0728
Properties
Complexity:
768
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
431.044g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
431.394g/mol
Monoisotopic Mass:
431.044g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
132A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| Comparison of negative ion electrospray mass spectra measured by seven tandem mass analyzers towards library formation. | Rapid communications in mass spectrometry : RCM 20080101 |
| Final report on the safety assessment of Acid Violet 43. | International journal of toxicology 20010101 |
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