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Basazol Orange 8512 structure
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Basazol Orange 8512

TL;DR: Basazol Orange 8512 (CAS 118207-99-1) is a chemical compound with molecular formula C21H22ClN3O3 and molecular weight 399.13498 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-(dimethylamino)ethyl 2-[(2-hydroxynaphthalen-1-yl)diazenyl]benzoate;hydrochloride

Also Known As: Basazol Orange 8512, Benzoic acid, 2-((2-hydroxy-1-naphthalenyl)azo)-, 2-(dimethylamino)ethyl ester, monohydrochloride, Benzoic acid, 2-[(2-hydroxy-1-naphthalenyl)azo]-, 2-(dimethylamino)ethyl ester, monohydrochloride, 2-dimethylaminoethyl 2-[(2E)-2-(2-oxonaphthalen-1-ylidene)hydrazinyl]benzoate hydrochloride, 2-(Dimethylamino)ethyl 2-[(2-hydroxynaphthalen-1-yl)diazenyl]benzoate--hydrogen chloride (1/1)

CAS Number
118207-99-1
Molecular Formula
C21H22ClN3O3
Molecular Weight
399.13498 g/mol
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Technical Specifications

Molecular FormulaC21H22ClN3O3
Molecular Weight399.13498 g/mol
XLogP5.1
Topological Polar Surface Area (TPSA)74.5 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors6
Rotatable Bonds7
Exact Mass399.13498 Da
Heavy Atoms28
Complexity511.0
SMILESCN(C)CCOC(=O)C1=CC=CC=C1N=NC2=C(C=CC3=CC=CC=C32)O.Cl
InChIKeyKDCABFSKIRXMLK-UHFFFAOYSA-N

Chemical Property Profile of Basazol Orange 8512

XLogP
5.1
TPSA (Topological Polar Surface Area)
74.5
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
6
Rotatable Bonds
7
Heavy Atoms
28
Complexity
511.0
Exact Mass
399.13498
Monoisotopic Mass
399.13498
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 Basazol Orange 8512

The XLogP value of 5.1 indicates that Basazol Orange 8512 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Basazol Orange 8512. Following Lipinski's Rule of Five, Basazol Orange 8512 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Basazol Orange 8512?

The CAS number of Basazol Orange 8512 is 118207-99-1.

What is the molecular formula of Basazol Orange 8512?

The molecular formula of Basazol Orange 8512 is C21H22ClN3O3.

What is the molecular weight of Basazol Orange 8512?

The molecular weight of Basazol Orange 8512 is 399.13498 g/mol.

Where can I buy Basazol Orange 8512?

You can request a quote for Basazol Orange 8512 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Basazol Orange 8512?

Yes, CoreyChem provides custom synthesis services for Basazol Orange 8512 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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