| CAS Number | 8003-59-6 |
| Catalog Number | AG003NOJ(AGN-PC-0UG29U) |
| Chemical Name | Acid Red 9 , |
| EC Number | 616-815-5 |
| IUPAC Name | sodium;6-[(2-hydroxynaphthalen-1-yl)diazenyl]naphthalene-1-sulfonate |
| InChI | InChI=1S/C20H14N2O4S.Na/c23-18-11-8-13-4-1-2-6-17(13)20(18)22-21-15-9-10-16-14(12-15)5-3-7-19(16)27(24,25)26;/h1-12,23H,(H,24,25,26);/q;+1/p-1 |
| InChI Key | GETWKXDZCSCODM-UHFFFAOYSA-M |
| MDL Number | MFCD00151319 |
| Molecular Formula | C20H13N2NaO4S |
| Molecular Weight | 400.3830 |
| SMILES | Oc1ccc2c(c1N=Nc1ccc3c(c1)cccc3S(=O)(=O)[O-])cccc2.[Na+] |
| Synonyms | Silk Scarlet,
8003-59-6,
C20H13N2O4S.Na,
AKOS015902405,
AKOS025310840,
1-Naphthalenesulfonic acid, 6-((2-hydroxy-1-naphthalenyl)azo)-, monosodium salt, mixt. with 7-((2-hydroxy-1-naphthalenyl)azo)-1-naphthalenesulfonic acid monosodium salt,
6-((2-Hydroxy-1-naphthalenyl)azo)-1-naphthalenesulfonic acid monosodium salt, mixt. with 7-((2-hydroxy-1-naphthalenyl)azo)-1-naphthalenesulfonic acid monosodium salt,
I14-19799,
sodium (E)-6-((2-hydroxynaphthalen-1-yl)diazenyl)naphthalene-1-sulfonate,
Acid Red 9,
C.I. Direct Black 9,
CID9577487,
T172,
|
| Complexity | 653 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 400.049g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 28 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 400.384g/mol |
| Monoisotopic Mass | 400.049g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 111A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
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Hazard Class
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\N
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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\N
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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\N
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Certificate of Analysis
Lot Number