Structure

Vat Brown 5

CAS
3989-75-1
Catalog Number
ACM3989751
Category
Vat Dyes
Molecular Weight
396.489
Molecular Formula
C24H12O2S2

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Specification

Synonyms
2-(1-oxonaphtho[2,1-b]thien-2(1H)-ylidene)naphtho[2,1-b]thiophen-1(2H)-one;Vat brown 5 (C.I. 73410);C.I.73410;C.I.Pigment Brown 27;C.I.Vat Brown 5;Calcotone Brown 2R;Lithosol Fast Brown GP;Δ2,2'(1H,1'H)-Binaphtho[2,1-b]thiophene-1,1'-dione
What is the molecular formula of Vat Brown 5?

The molecular formula of Vat Brown 5 is C24H12O2S2.

What is the molecular weight of Vat Brown 5?

The molecular weight of Vat Brown 5 is 396.5 g/mol.

What is the IUPAC name of Vat Brown 5?

The IUPAC name of Vat Brown 5 is (2E)-2-(1-oxobenzo[e][1]benzothiol-2-ylidene)benzo[e][1]benzothiol-1-one.

What is the InChI key of Vat Brown 5?

The InChI key of Vat Brown 5 is RNJIWICOCATEFH-WCWDXBQESA-N.

What is the Canonical SMILES of Vat Brown 5?

The Canonical SMILES of Vat Brown 5 is C1=CC=C2C(=C1)C=CC3=C2C(=O)C(=C4C(=O)C5=C(S4)C=CC6=CC=CC=C65)S3.

What is the CAS number of Vat Brown 5?

The CAS number of Vat Brown 5 is 3989-75-1.

What is the XLogP3-AA value of Vat Brown 5?

The XLogP3-AA value of Vat Brown 5 is 6.6.

How many hydrogen bond donor counts are present in Vat Brown 5?

There are 0 hydrogen bond donor counts present in Vat Brown 5.

What is the topological polar surface area of Vat Brown 5?

The topological polar surface area of Vat Brown 5 is 84.7 Å2.

Is Vat Brown 5 a canonicalized compound?

Yes, Vat Brown 5 is a canonicalized compound.

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