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Barium lithol red structure
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Barium lithol red

TL;DR: Barium lithol red (CAS 1103-38-4) is a chemical compound with molecular formula C40H26BaN4O8S2 and molecular weight 892.0245 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

barium(2+);bis(2-[(2-hydroxynaphthalen-1-yl)diazenyl]naphthalene-1-sulfonate)

Also Known As: Pigment Red 49:1, Barium lithol, BARIUM LITHOL RED, Poster Red, Calcotone Red B

CAS Number
1103-38-4
Molecular Formula
C40H26BaN4O8S2
Molecular Weight
892.0245 g/mol
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Application Areas

Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (9 patents)

Technical Specifications

Molecular FormulaC40H26BaN4O8S2
Molecular Weight892.0245 g/mol
XLogP9.66
Topological Polar Surface Area (TPSA)221.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors12
Rotatable Bonds4
Exact Mass892.0245 Da
Heavy Atoms55
Complexity634.0
SMILESC1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C4=CC=CC=C4C=C3)S(=O)(=O)[O-])O.C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C4=CC=CC=C4C=C3)S(=O)(=O)[O-])O.[Ba+2]
InChIKeyLFZDEAVRTJKYAF-UHFFFAOYSA-L

Chemical Property Profile of Barium lithol red

XLogP
9.66
TPSA (Topological Polar Surface Area)
221.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
12
Rotatable Bonds
4
Heavy Atoms
55
Complexity
634.0
Exact Mass
892.0245
Monoisotopic Mass
892.0245
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Barium lithol red

The XLogP value of 9.66 indicates that Barium lithol red is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 221.0 Ų indicates high polarity, suggesting Barium lithol red may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Barium lithol red has 2 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Barium lithol red?

The CAS number of Barium lithol red is 1103-38-4.

What is the molecular formula of Barium lithol red?

The molecular formula of Barium lithol red is C40H26BaN4O8S2.

What is the molecular weight of Barium lithol red?

The molecular weight of Barium lithol red is 892.0245 g/mol.

Where can I buy Barium lithol red?

You can request a quote for Barium lithol red directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Barium lithol red?

Yes, CoreyChem provides custom synthesis services for Barium lithol red and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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