CAS No.57741-47-6,Tracid Red 2bs Suppliers

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Basic Information

Molecular Structure:
CAS No.:	57741-47-6
Name:	Tracid Red 2bs

Formula:	C₁₇H₁₀ClF₃N₃NaO₄S
Molecular Weight:	467.7819796
Synonyms:	2-Naphthalenesulfonicacid, 6-amino-5-[[4-chloro-2-(trifluoromethyl)phenyl]azo]-4-hydroxy-,monosodium salt (9CI);Acid Red 266;Acid Red E-RM;Aminyl Red E 2BL;Best AcidRed A 2B;C.I. Acid Red 266;Concorde Acid Red 2BSA;Covanyl Red C 2B;DiacidRed N 2B;Everacid Red A 2B;Fabrinyl Red 2B;Kayanol Red NB;Kenamide Red G2B;Merpacyl Red B;Mitsui Nylon Fast Red BB;Nylanthrene Red B 2BSA;NylomineRed A 2B;Nylosan Red E-BM;Simacid Red 24903;Suminol Fast Red BB;
EINECS:	260-925-2
Density:	1.68[at 20℃]
Boiling Point:	806℃[at 101 325 Pa]
Solubility:	248mg/L at 25℃
PSA:	136.55000
LogP:	6.78130

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Specification

The CAS register number of 2-Naphthalenesulfonic acid, 6-amino-5-(2-(4-chloro-2-(trifluoromethyl)phenyl)diazenyl)-4-hydroxy-, sodium salt (1:1) is 57741-47-6. It also can be called as 6-Amino-5-((4-chloro-2-(trifluoromethyl)phenyl)azo)-4-hydroxy-2-naphthalenesulfonic acid, sodium salt and the IUPAC name about this chemical is sodium 5-[2-[4-chloro-2-(trifluoromethyl)phenyl]hydrazinyl]-6-imino-4-oxonaphthalene-2-sulfonate. The molecular formula about this chemical is C₁₇H₁₀ClF₃N₃NaO₄S and the molecular weight is 467.7819796. It belongs to the Organics.

Physical properties about 2-Naphthalenesulfonic acid, 6-amino-5-(2-(4-chloro-2-(trifluoromethyl)phenyl)diazenyl)-4-hydroxy-, sodium salt (1:1) are: (1)ACD/LogP: 1.81; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 7; (4)#H bond donors: 4; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 98.66Å².

You can still convert the following datas into molecular structure:
(1)SMILES: [Na+].FC(F)(F)c1cc(Cl)ccc1NNC=3C(=[N@H])/C=C\C\2=C\C(=C/C(=O)C/2=3)S([O-])(=O)=O
(2)InChI: InChI=1/C17H11ClF3N3O4S.Na/c18-9-2-4-13(11(6-9)17(19,20)21)23-24-16-12(22)3-1-8-5-10(29(26,27)28)7-14(25)15(8)16;/h1-7,22-24H,(H,26,27,28);/q;+1/p-1/b22-12+;
(3)InChIKey: DDZWZGVFWCSPRV-JFAWFOPTBA
(4)Std. InChI: InChI=1S/C17H11ClF3N3O4S.Na/c18-9-2-4-13(11(6-9)17(19,20)21)23-24-16-12(22)3-1-8-5-10(29(26,27)28)7-14(25)15(8)16;/h1-7,22-24H,(H,26,27,28);/q;+1/p-1/b22-12+;
(5)Std. InChIKey: DDZWZGVFWCSPRV-RSRKELGKSA-M