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Structure

Lucifer yellow vs dilithium salt

CAS
71231-14-6
Catalog Number
ACM71231146
Category
Bioelectronics
Molecular Weight
550.5g/mol
Molecular Formula
C20H12Li2N2O10S3

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Specification

Synonyms
4-AMINO-N-[3-(VINYLSULFONYL)-PHENYL]NAPHTHALIMIDE-3,6-DISULFONATE DILITHIUM SALT;LUCIFER YELLOW VS;LUCIFER YELLOW VS DILITHIUM SALT;DILITHIUM 4-AMINO-N-[3-(VINYLSULFONYL)PHENYL]NAPHTHALIMIDE-3,6-DISULFONATE;LUCIFER YELLOW VS DILITHIUM SALT, FOR FL UORESCE
IUPAC Name
dilithium;6-amino-2-(3-ethenylsulfonylphenyl)-1,3-dioxobenzo[de]isoquinoline-5,8-disulfonate
Canonical SMILES
[Li+].[Li+].C=CS(=O)(=O)C1=CC=CC(=C1)N2C(=O)C3=CC(=CC4=C3C(=CC(=C4N)S(=O)(=O)[O-])C2=O)S(=O)(=O)[O-]
InChI
InChI=1S/C20H14N2O10S3.2Li/c1-2-33(25,26)11-5-3-4-10(6-11)22-19(23)14-8-12(34(27,28)29)7-13-17(14)15(20(22)24)9-16(18(13)21)35(30,31)32;;/h2-9H,1,21H2,(H,27,28,29)(H,30,31,32);;/q;2*+1/p-2
InChI Key
PSJNJVOFDDMXDP-UHFFFAOYSA-L
Complexity
1200
Covalently-Bonded Unit Count
3
Exact Mass
549.997415g/mol
Formal Charge
0
H-Bond Acceptor
11
H-Bond Donor
1
Heavy Atom Count
37
Monoisotopic Mass
549.997415g/mol
Rotatable Bond Count
3
What is the molecular formula of Lucifer Yellow VS dilithium salt?

The molecular formula of Lucifer Yellow VS dilithium salt is C20H12Li2N2O10S3.

When was Lucifer Yellow VS dilithium salt created and modified in PubChem?

Lucifer Yellow VS dilithium salt was created on March 21, 2006, and modified on November 25, 2023.

What is the IUPAC Name of Lucifer Yellow VS dilithium salt?

The IUPAC Name of Lucifer Yellow VS dilithium salt is dilithium; 6-amino-2-(3-ethenylsulfonylphenyl)-1,3-dioxobenzo[de]isoquinoline-5,8-disulfonate.

What is the InChI of Lucifer Yellow VS dilithium salt?

The InChI of Lucifer Yellow VS dilithium salt is InChI=1S/C20H14N2O10S3.2Li/c1-2-33(25,26)11-5-3-4-10(6-11)22-19(23)14-8-12(34(27,28)29)7-13-17(14)15(20(22)24)9-16(18(13)21)35(30,31,32);;/h2-9H,1,21H2,(H,27,28,29)(H,30,31,32);;/q;2*+1/p-2.

What is the InChIKey of Lucifer Yellow VS dilithium salt?

The InChIKey of Lucifer Yellow VS dilithium salt is PSJNJVOFDDMXDP-UHFFFAOYSA-L.

What is the Canonical SMILES of Lucifer Yellow VS dilithium salt?

The Canonical SMILES of Lucifer Yellow VS dilithium salt is [Li+].[Li+].C=CS(=O)(=O)C1=CC=CC(=C1)N2C(=O)C3=CC=CC4=C3C(=CC(=C4N)S(=O)(=O)[O-])C2=O)S(=O)(=O)[O-].

What is the molecular weight of Lucifer Yellow VS dilithium salt?

The molecular weight of Lucifer Yellow VS dilithium salt is 550.5 g/mol.

How many hydrogen bond donor counts does Lucifer Yellow VS dilithium salt have?

Lucifer Yellow VS dilithium salt has 1 hydrogen bond donor count.

What is the topological polar surface area of Lucifer Yellow VS dilithium salt?

The topological polar surface area of Lucifer Yellow VS dilithium salt is 237Ų.

Is the compound canonicalized in PubChem?

Yes, the compound is canonicalized in PubChem.

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