Acid blue 1

• Catalog Number: ACM129179
• Product Name: Acid blue 1
• CAS: 129-17-9
• Category: Acid Dyes
• Synonyms: Ethanaminium, N-(4-((4-(diethylamino)phenyl)(2,4-disulfophenyl)methylene)-2,5-cyclohexadien-1-ylidene)-N-ethyl-, hydroxide, inner salt, sodium salt
• IUPAC Name: sodium;4-[[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)methyl]benzene-1,3-disulfonate
• Molecular Weight: 566.66
• Molecular Formula: C27H31N2NaO6S2
• Canonical SMILES: CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CC)CC)C=C2)C3=C(C=C(C=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+]
• InChI: SJEYSFABYSGQBG-UHFFFAOYSA-M
• InChI Key: InChI=1S/C27H32N2O6S2.Na/c1-5-28(6-2)22-13-9-20(10-14-22)27(21-11-15-23(16-12-21)29(7-3)8-4)25-18-17-24(36(30,31)32)19-26(25)37(33,34)35;/h9-19H,5-8H2,1-4H3,(H-,30,31,32,33,34,35);/q;+1/p-1
• Melting Point: >250°C
• Density: 6.9 (10g/l, H2O, 20°C)
• Physical State: Solid

Custom Q&A

What is the molecular formula of ACID BLUE 1?

The molecular formula of ACID BLUE 1 is C27H31N2NaO6S2.

What is the molecular weight of ACID BLUE 1?

The molecular weight of ACID BLUE 1 is 566.7 g/mol.

What is the IUPAC name of ACID BLUE 1?

The IUPAC name of ACID BLUE 1 is sodium;4-[[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)methyl]benzene-1,3-disulfonate.

What is the InChI of ACID BLUE 1?

The InChI of ACID BLUE 1 is InChI=1S/C27H32N2O6S2.Na/c1-5-28(6-2)22-13-9-20(10-14-22)27(21-11-15-23(16-12-21)29(7-3)8-4)25-18-17-24(36(30,31)32)19-26(25)37(33,34)35;/h9-19H,5-8H2,1-4H3,(H-,30,31,32,33,34,35);/q;+1/p-1.

What is the InChIKey of ACID BLUE 1?

The InChIKey of ACID BLUE 1 is SJEYSFABYSGQBG-UHFFFAOYSA-M.

What is the canonical SMILES of ACID BLUE 1?

The canonical SMILES of ACID BLUE 1 is CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CC)CC)C=C2)C3=C(C=C(C=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].

What is the CAS number of ACID BLUE 1?

The CAS number of ACID BLUE 1 is 129-17-9.

What is the UNII of ACID BLUE 1?

The UNII of ACID BLUE 1 is FH1929ICIT.

What is the hydrogen bond donor count of ACID BLUE 1?

The hydrogen bond donor count of ACID BLUE 1 is 0.

What is the Hydrogen Bond Acceptor Count of Acid blue 1?

The Hydrogen Bond Acceptor Count of Acid blue 1 is 7.

What is the Topological Polar Surface Area of Acid blue 1?

The Topological Polar Surface Area of Acid blue 1 is 137?2.

How many Hydrogen Bond Acceptor Count does Acid blue 1 have?

Acid blue 1 has 7 Hydrogen Bond Acceptor Count.

What are the synonyms for ACID BLUE 1?

The synonyms for ACID BLUE 1 are Sulfan Blue, Acid blue 1, 129-17-9, Patent Blue VF, Patent Blue, and more.

What is the structure of ACID BLUE 1?

The structure of ACID BLUE 1 is not provided in the reference.

When was ACID BLUE 1 created and modified?

ACID BLUE 1 was created on June 24, 2005, and last modified on December 23, 2023.

Is ACID BLUE 1 a laboratory chemical?

Yes, ACID BLUE 1 is listed as a laboratory chemical in the reference.

Does ACID BLUE 1 have any hydrogen bond donor count?

No, ACID BLUE 1 does not have any hydrogen bond donor count.