DIRECT YELLOW 50

• CAS: 3214-47-9
• Catalog Number: ACM3214479
• Category: Direct Dyes
• Molecular Weight: 956.82
• Molecular Formula: C₃₅H₂₄N₆Na₄O₁₃S₄
• Synonyms: 1,5-Naphthalenedisulfonicacid,3,3'-[carbonylbis[imino(2-methyl-4,1-phenylene)azo]]bis-,tetrasodiumsalt;abcoldirectyellowrlsw;AmanilSupraYellowLRL;C.I.DirectYellow50(29025);DiazolLightYellowRS;DiphenylYellowRLSW;directyellow50(c.i.29025);DurazolYellowFRR
• IUPAC Name: 3-[[4-[[4-[(4,8-disulfonaphthalen-2-yl)diazenyl]-3-methylphenyl]carbamoylamino]-2-methylphenyl]diazenyl]naphthalene-1,5-disulfonic acid; sodium
• Canonical SMILES: CC1=C(C=CC(=C1)NC(=O)NC2=CC(=C(C=C2)N=NC3=CC(=C4C=CC=C(C4=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])C)N=NC5=CC(=C6C=CC=C(C6=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]
• InChI Key: ALFJBESOFAPBOC-UHFFFAOYSA-N
• Appearance: orange to red brown powder or crystals
• EC Number: 221-728-7
• Exact Mass: 955.98700
• H-Bond Acceptor: 17
• H-Bond Donor: 6
• WGK Germany: 3

Custom Q&A

What is the molecular formula of Direct Yellow 50?

The molecular formula of Direct Yellow 50 is C35H24N6Na4O13S4.

What is the molecular weight of Direct Yellow 50?

The molecular weight of Direct Yellow 50 is 956.8 g/mol.

What is the IUPAC name of Direct Yellow 50?

The IUPAC name of Direct Yellow 50 is tetrasodium;3-[[4-[[4-[(4,8-disulfonatonaphthalen-2-yl)diazenyl]-3-methylphenyl]carbamoylamino]-2-methylphenyl]diazenyl]naphthalene-1,5-disulfonate.

What is the InChI code of Direct Yellow 50?

The InChI code of Direct Yellow 50 is InChI=1S/C35H28N6O13S4.4Na/c1-19-13-21(9-11-29(19)40-38-23-15-27-25(33(17-23)57(49,50)51)5-3-7-31(27)55(43,44)45)36-35(42)37-22-10-12-30(20(2)14-22)41-39-24-16-28-26(34(18-24)58(52,53)54)6-4-8-32(28)56(46,47)48;;;;/h3-18H,1-2H3,(H2,36,37,42)(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54);;;;/q;4*+1/p-4.

What is the canonical SMILES of Direct Yellow 50?

The canonical SMILES of Direct Yellow 50 is CC1=C(C=CC(=C1)NC(=O)NC2=CC(=C(C=C2)N=NC3=CC4=C(C=CC=C4S(=O)(=O)[O-])C(=C3)S(=O)(=O)[O-])C)N=NC5=CC6=C(C=CC=C6S(=O)(=O)[O-])C(=C5)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].

What is the CAS number of Direct Yellow 50?

The CAS number of Direct Yellow 50 is 3214-47-9.

What is the hydrogen bond donor count of Direct Yellow 50?

The hydrogen bond donor count of Direct Yellow 50 is 2.

What is the hydrogen bond acceptor count of Direct Yellow 50?

The hydrogen bond acceptor count of Direct Yellow 50 is 17.

How many rotatable bonds are present in Direct Yellow 50?

There are 6 rotatable bonds present in Direct Yellow 50.

What is the topological polar surface area of Direct Yellow 50?

The topological polar surface area of Direct Yellow 50 is 353 ?2.