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Procaine Borate structure
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Procaine Borate

TL;DR: Procaine Borate (CAS 149-13-3) is a chemical compound with molecular formula C13H25B5N2O12 and molecular weight 456.1873 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

硼酸普鲁卡因

2-(diethylamino)ethyl 4-aminobenzoate;oxoborinic acid

Also Known As: Procaine borate, Procaine borate [NF], Vitamin H3 borate, 2-(Diethylamino)ethyl p-aminobenzoate borate (1:5), boric acid;2-(diethylamino)ethyl 4-aminobenzoate

CAS Number
149-13-3
Molecular Formula
C13H25B5N2O12
Molecular Weight
456.1873 g/mol
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Technical Specifications

Molecular FormulaC13H25B5N2O12
Molecular Weight456.1873 g/mol
XLogP-3.52
Topological Polar Surface Area (TPSA)242.0 Ų
Hydrogen Bond Donors6
Hydrogen Bond Acceptors14
Rotatable Bonds7
Exact Mass455.19092 Da
Heavy Atoms32
Complexity232.0
SMILESB(=O)O.B(=O)O.B(=O)O.B(=O)O.B(=O)O.CCN(CC)CCOC(=O)C1=CC=C(C=C1)N
InChIKeyGTQXPCWVIUCJCK-UHFFFAOYSA-N

Chemical Property Profile of Procaine Borate

XLogP
-3.52
TPSA (Topological Polar Surface Area)
242.0
Hydrogen Bond Donors
6
Hydrogen Bond Acceptors
14
Rotatable Bonds
7
Heavy Atoms
32
Complexity
232.0
Exact Mass
455.19092
Monoisotopic Mass
456.1873
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 Procaine Borate

The XLogP value of -3.52 indicates that Procaine Borate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 242.0 Ų indicates high polarity, suggesting Procaine Borate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Procaine Borate has 6 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Procaine Borate?

The CAS number of Procaine Borate is 149-13-3.

What is the molecular formula of Procaine Borate?

The molecular formula of Procaine Borate is C13H25B5N2O12.

What is the molecular weight of Procaine Borate?

The molecular weight of Procaine Borate is 456.1873 g/mol.

Where can I buy Procaine Borate?

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

Does CoreyChem offer custom synthesis for Procaine Borate?

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

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