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| CAS No.: | 2829-42-7 |
|---|---|
| Name: | Direct Fast Yellow 5GL |
| Molecular Structure: | |
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| Formula: | C27H20N6O7·2Na |
| Molecular Weight: | 586.45 |
| Synonyms: | Benzoicacid, 3,3'-[carbonylbis(imino-4,1-phenyleneazo)]bis[6-hydroxy-, disodium salt(9CI);C.I. Direct Yellow 26 (7CI);C.I. Direct Yellow 26, disodium salt (8CI);Atlantic Fast Yellow 5GL;Belamine Fast Yellow 5GL;Benzanol Fast Yellow 5GL;C.I. 25300;Dialuminous Yellow GG;Dicorel Yellow LG;Direct Yellow 26;Fastolite Yellow 5GL;Fastusol Yellow GGA-CF;Mitsui Direct Fast Yellow 2GLX;Pontamine Fast Yellow 5GL;Sirius Yellow GG;Solantine Yellow 5GAD;Tertrodirect Fast Yellow 6G;Triantine Fast Yellow GN; |
| EINECS: | 220-592-6 |
| PSA: | 211.29000 |
| LogP: | 4.44560 |
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- 5156-58-1N-(1-Benzyl-4-pipperidinyl)-N-phenylpropanamide HCl
- 81281-59-67-Benzylideneaminotheophylline
- 50288-62-5threo-Phenyl-2-piperidyl acetamide
- 82993-81-5D-threo-Ritalinic acid hydrochloride
- 47087-37-6Z-D-Glu-OMe
- 73441-42-6METHYL-5-CHLORO-2,2-DIMETHYLVALERATE
- 68439-39-4Poly(oxy-1,2-ethanediyl), alpha-(2-ethylhexyl)-omega-hydroxy-,
- 852475-26-4MC1568
- Total:28 Page 1 of 1 1
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Specification
The CAS registry number of Direct Fast Yellow 5GL is 2829-42-7. The IUPAC name is (3E)-3-(2-{4-[({4-[(2E)-2-(3-carboxylato-4-oxocyclohexa-2,5-dien-1-ylidene)hydrazinyl]phenyl}carbamoyl)amino]phenyl}hydrazinylidene)-6-oxocyclohexa-1,4-diene-1-carboxylate. Its EINECS number is 220-592-6. It belongs to the product categories of Dyes and Pigments; Organics. In addition, the molecular formula is C27H20N6O7·2Na and the formula weight is 586.45. What's more, it should be stored in a airtight, cool and dry place. This material may have harm to the environment, especially to the water.
Physical properties of Direct Fast Yellow 5GL are: (1)ACD/LogP: 1.85; (2)# of Rule of 5 Violations: 3; (3)ACD/LogD (pH 5.5): -3; (4)ACD/BCF (pH 5.5): 1 ; (5)ACD/KOC (pH 5.5): 1; (6)#H bond acceptors: 13; (7)#H bond donors: 6; (8)#Freely Rotating Bonds: 8; (9)Polar Surface Area: 163.49 Å2.
You can still convert the following datas into molecular structure:
(1)SMILES: [Na+].[Na+].O=C([O-])\C4=CC(=N/Nc3ccc(NC(=O)Nc2ccc(N/N=C/1\C=C/C(=O)C(\C([O-])=O)=C\1)cc2)cc3)/C=C\C4=O
(2)InChI: InChI=1S/C27H20N6O7.2Na/c34-23-11-9-19(13-21(23)25(36)37)32-30-17-5-1-15(2-6-17)28-27(40)29-16-3-7-18(8-4-16)31-33-20-10-12-24(35)22(14-20)26(38)39;;/h1-14,30-31H,(H,36,37)(H,38,39)(H2,28,29,40);;/q;2*+1/p-2/b32-19+,33-20+
(3)InChIKey: NPQLRSWJRSHFMF-CTLWQRGVSA-L