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| CAS No.: | 6459-94-5 |
|---|---|
| Name: | ACID RED 114 |
| Molecular Structure: | |
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| Formula: | C37H30 N4 O10 S3 . 2 Na |
| Molecular Weight: | 830.85 |
| Synonyms: | 1,3-Naphthalenedisulfonicacid,8-[[3,3'-dimethyl-4'-[[4-[[(4-methylphenyl)sulfonyl]oxy]phenyl]azo][1,1'-biphenyl]-4-yl]azo]-7-hydroxy-,disodium salt (9CI); C.I. Acid Red 114 (7CI); C.I. Acid Red 114, disodium salt(8CI); Acid Leather Red BG; Acid Milling Red BS; Acid Milling Red RS; Acid Red114; Acid Red F-RS; Acid Red P-RS; Acid Red RS; Amacid Milling Red PRS; AnadurmRed M-R; Apollo Nylon Fast Red R; Atul Acid Milling Red RS; Benzyl Fast Red BG;Benzyl Red BR; Best Acid Milling Red RS; C.I. 23635; Colomill Red RS; ConcordeAcid Red M-RS; Concorde Leather Red RSN; Covalene Red RS; Covalene Scarlet RS;Covanyl Scarlet RS; Daedo Acid Red RS; Dinacid Milling Red RG; Dycosweak AcidRS; Eniacid Fast Red R; Erionyl Red RS; Erionyl Red RS 125; Everacid MillingRed RS; Everlan Red RS; Fabracid Red M-RS; Fenafor Red PB; Folan Red B; IndacidMilling Red RS; Kayanol Milling Red RS; Kayanol Milling Red RS 125; KenamideRed K 2R; Kenanthrol Red R; Leather Fast Red B; Lerui Acid Red F-RS; Levanol RedGG; Midlon Red PRS; Milling Fast Red B; Milling Fast Red R; Milling Red B;Milling Red BB; Milling Red SWB; Monacid Red RS; Multicuer Red R; Navimill RedRS; Navitan Red RS; Pacid Red RS; Polar Red RS; Ratna Acid Red RS; Rifa AcidFast Red RS; Rifa Leather Red R; Sandolan Red N-RS; Sandolan Red N-RSI;Sandolan Red RSNI; Sella Fast Red RS; Simacid Red 24900; Sulphonol Red R;Suminol Milling Red RS; Suminol Milling Red RS 125; Supranol Fast Red 3G;Supranol Fast Red GG; Supranol Red PBX-CF; Supranol Red R; Telon Fast Red GG;Tertracid Milling Red B; Triacid Fast Red RS; Vondamol Fast Red RS |
| EINECS: | 229-272-0 |
| Boiling Point: |
Vapour density: |
| Solubility: | Toxicity data (The meaning of any tox">
Stability
Toxicology
Toxicity data |
| Appearance: | solid |
| Hazard Symbols: | Xn,T |
| Risk Codes: | 40-45 |
| Safety: | Confirmed carcinogen with experimental carcinogenic data. Mutation data reported. When heated to decomposition it emits toxic vapors of NOx and SOx. |
| PSA: | 252.58000 |
| LogP: | 11.78670 |
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Chemistry
Molecular Formula: C37H28N4Na2O10S3
Molar mass: 830.81 g/mol
EINECS: 229-272-0
Appearance: Dark red powder
Stable: Stable, incompatible with strong oxidizing agents
Product categories of C.I. Acid red 114 (6459-94-5): Dyes and Pigments;Organics;Stains
Structure of C.I. Acid red 114 (6459-94-5):
H-Bond Donor: 1
H-Bond Acceptor: 4
IUPAC Name: Disodium(8Z)-8-[[2-methyl-4-[3-methyl-4-[4-(4-methylphenyl)sulfonyloxyphenyl]
diazenylphenyl]phenyl]hydrazinylidene]-7-oxonaphthalene-1,3-disulfonate
Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)N=NC3=C(C=C(C=C3)C4=CC(=C(C=C4)NN=C5C(=O)C=CC6=CC(=CC(=C65)S(=O)(=O)[O-])S(=O)(=O)[O-])C)C.[Na+].[Na+]
Isomeric SMILES: CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)N=NC3=C(C=C(C=C3)C4=CC(=C(C=C4)N/N=C/5\C(=O)C=CC6=CC(=CC(=C65)S(=O)(=O)[O-])S(=O)(=O)[O-])C)C.[Na+].[Na+]
InChI: InChI=1S/C37H30N4O10S3.2Na/c1-22-4-13-30(14-5-22)54(49,50)51-29-11-9-28(10-12-29)38-39-32-15-6-25(18-23(32)2)26-7-16-33(24(3)19-26)40-41-37-34(42)17-8-27-20-31(52(43,44)45)21-35(36(27)37)53(46,47)48;;/h4-21,40H,1-3H3,(H,43,44,45)(H,46,47,48);;/q;2*+1/p-2/b39-38?,41-37+;;
InChIKey: PVLKQJLDEXCKNY-BSSRIQHJSA-L
Uses
C.I. Acid red 114 (6459-94-5) can be used for dyeing of wool, silk and wool blends.
Production
With 3,3 '- dimethyl-benzidine, G salt, phenol and p-toluenesulfonyl chloride as raw materials, first, take 3,3' - dimethyl-benzidine for nitrogen effect, and then, by coupling with Salt-G and Phenol , and finally with p-toluenesulfonyl chloride for condensation. After filtration, drying, grinding, the product can be obtained.
Toxicity Data With Reference
| 1. | mmo-sat 300 nmol/plate | MUREAV Mutation Research. 136 (1984),33. | ||
| 2. | mma-sat 125 µg/plate | VHTODE Veterinary and Human Toxicology. 22 (1980),413. |
Consensus Reports
IARC Cancer Review: Group 2B IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man . 57 , 1993,p. 247.(World Health Organization, Internation Agency for Research on Cancer,Lyon, France.: ) (Single copies can be ordered from WHO Publications Centre U.S.A., 49 Sheridan Avenue, Albany, NY 12210) ; Animal Sufficient Evidence IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man . 57 , 1993,p. 247.(World Health Organization, Internation Agency for Research on Cancer,Lyon, France.: ) (Single copies can be ordered from WHO Publications Centre U.S.A., 49 Sheridan Avenue, Albany, NY 12210) ; Human Inadequate Evidence IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man . 57 , 1993,p. 247.(World Health Organization, Internation Agency for Research on Cancer,Lyon, France.: ) (Single copies can be ordered from WHO Publications Centre U.S.A., 49 Sheridan Avenue, Albany, NY 12210) . NTP Carcinogenesis Studies (drinking); Clear Evidence: rat NTPTR* National Toxicology Program Technical Report Series. (Research Triangle Park, NC 27709) No. NTP-TR-405 ,1991. . Reported in EPA TSCA Inventory.
Safety Profile
Confirmed carcinogen with experimental carcinogenic data. Mutation data reported. When heated to decomposition it emits toxic vapors of NOx and SOx.
Hazard Codes: Xn
Risk Statements:
40: Limited evidence of a carcinogenic effect
Safety Statements:
22: Do not breathe dust
36: Wear suitable protective clothing
37: Wear suitable gloves
39: Wear eye/face protection
45: In case of accident or if you feel unwell, seek medical advice immediately (show label where possible)
Specification
C.I. Acid red 114 (6459-94-5) also can be called C.I. Acid Red 114, disodium salt and Disodium 8-((3,3'-dimethyl-4'-(4-(4-methylphenylsulphonyloxy)phenylazo)(1,1'-biphenyl)-4-yl)azo)-7-hydroxynaphthalene-1,3-disulphonate .