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Pigment orange 17 structure
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Pigment orange 17

TL;DR: Pigment orange 17 (CAS 15782-04-4) is a chemical compound with molecular formula C32H22BaN4O8S2 and molecular weight 791.99316 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

barium(2+);bis(4-[(2-hydroxynaphthalen-1-yl)diazenyl]benzenesulfonate)

Also Known As: Pigment orange 17, C16H12N2O4S.1/2Ba, C16-H12-N2-O4-S.1/2Ba, Benzenesulfonic acid, 4-[(2-hydroxy-1-naphthalenyl)azo]-, barium salt (2:1), C.I. Pigment Orange 17, barium salt (2:1)

CAS Number
15782-04-4
Molecular Formula
C32H22BaN4O8S2
Molecular Weight
791.99316 g/mol
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Technical Specifications

Molecular FormulaC32H22BaN4O8S2
Molecular Weight791.99316 g/mol
XLogP7.35
Topological Polar Surface Area (TPSA)221.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors12
Rotatable Bonds4
Exact Mass791.99316 Da
Heavy Atoms47
Complexity509.0
SMILESC1=CC=C2C(=C1)C=CC(=C2N=NC3=CC=C(C=C3)S(=O)(=O)[O-])O.C1=CC=C2C(=C1)C=CC(=C2N=NC3=CC=C(C=C3)S(=O)(=O)[O-])O.[Ba+2]
InChIKeyBEXFCYUYPJZRLU-UHFFFAOYSA-L

Chemical Property Profile of Pigment orange 17

XLogP
7.35
TPSA (Topological Polar Surface Area)
221.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
12
Rotatable Bonds
4
Heavy Atoms
47
Complexity
509.0
Exact Mass
791.99316
Monoisotopic Mass
791.99316
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 Pigment orange 17

The XLogP value of 7.35 indicates that Pigment orange 17 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 221.0 Ų indicates high polarity, suggesting Pigment orange 17 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pigment orange 17 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 Pigment orange 17?

The CAS number of Pigment orange 17 is 15782-04-4.

What is the molecular formula of Pigment orange 17?

The molecular formula of Pigment orange 17 is C32H22BaN4O8S2.

What is the molecular weight of Pigment orange 17?

The molecular weight of Pigment orange 17 is 791.99316 g/mol.

Where can I buy Pigment orange 17?

You can request a quote for Pigment orange 17 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Pigment orange 17?

Yes, CoreyChem provides custom synthesis services for Pigment orange 17 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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