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Alcian Yellow

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Name

Alcian Yellow

EINECS N/A
CAS No. 61968-76-1 Density N/A
PSA 170.08000 LogP 4.12600
Solubility Soluble in ethanol Melting Point 167-169°C (dec.)
Formula C40H46Cl2N8S4 Boiling Point N/A
Molecular Weight 802.5593 Flash Point N/A
Transport Information N/A Appearance Orange powder with a brown cast
Safety 45-53 Risk Codes 36/37/38-61
Molecular Structure Molecular Structure of 61968-76-1 (Alcian Yellow) Hazard Symbols ToxicT
Synonyms

AlcianYellow;Alcian Yellow G;Alcian Yellow GX;C.I. 12840;Ingrain Yellow 1;

 

Alcian Yellow Specification

The cas register number of Alcian Yellow is 61968-76-1. It also can be called as [Dimethylamino-[[2-[4-[4-[5-[(dimethylaminodimethylazaniumylidenemethyl)sulfanylmethyl]-6-methyl-1,3-benzothiazol-2-yl]phenyl]diazenylphenyl]-6-methyl-1,3-benzothiazol-5-yl]methylsulfanyl]methylidene]dimethylazanium chloride and the IUPAC Name about this chemical is [dimethylamino-[[2-[4-[[4-[5-[[dimethylamino(dimethylazaniumylidene)methyl]sulfanylmethyl]-6-methyl-1,3-benzothiazol-2-yl]phenyl]diazenyl]phenyl]-6-methyl-1,3-benzothiazol-5-yl]methylsulfanyl]methylidene]-dimethylazanium dichloride.

Physical properties about  are: (1)H-Bond Acceptor: 8; (2)Rotatable Bond Count: 12; (3)Exact Mass: 836.210532; (4)MonoIsotopic Mass: 836.210532; (5)Topological Polar Surface Area: 170; (6)Heavy Atom Count: 54; (7)Complexity: 1130; (8)Covalently-Bonded Unit Count: 3.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin, it may cause harm to the unborn child. When you are using it, please avoid exposure - obtain special instructions before use. In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)

You can still convert the following datas into molecular structure:
(1)SMILES: S(/C(=[N+](/C)C)N(C)C)Cc1cc2nc(sc2cc1C)c6ccc(/N=N/c5ccc(c3nc4cc(c(cc4s3)C)CS/C(=[N+](/C)C)N(C)C)cc5)cc6
(2)InChI: InChI=1/C40H46N8S4/c1-25-19-35-33(21-29(25)23-49-39(45(3)4)46(5)6)41-37(51-35)27-11-15-31(16-12-27)43-44-32-17-13-28(14-18-32)38-42-34-22-30(26(2)20-36(34)52-38)24-50-40(47(7)8)48(9)10/h11-22H,23-24H2,1-10H3/q+2/b44-43+
(3)InChIKey: QMKQNEXRGZFFKQ-VGFSZAGXBQ
(4)Std. InChI: InChI=1S/C40H46N8S4/c1-25-19-35-33(21-29(25)23-49-39(45(3)4)46(5)6)41-37(51-35)27-11-15-31(16-12-27)43-44-32-17-13-28(14-18-32)38-42-34-22-30(26(2)20-36(34)52-38)24-50-40(47(7)8)48(9)10/h11-22H,23-24H2,1-10H3/q+2/b44-43+
(5)Std. InChIKey: QMKQNEXRGZFFKQ-VGFSZAGXSA-N

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