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FluoroBora I structure
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FluoroBora I

TL;DR: FluoroBora I (CAS 75806-94-9) is a chemical compound with molecular formula C18H19BN2O4S and molecular weight 370.11584 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[3-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]phenyl]boronic acid

Also Known As: 3-(Dansylamino)phenylboronic acid, FluoroBora I, Dns-BBA, 3- phenylboronicacid, 3-dansylaminophenylboronic acid

CAS Number
75806-94-9
Molecular Formula
C18H19BN2O4S
Molecular Weight
370.11584 g/mol
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Application Areas

Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.

Analytical Reagents (10 patents) Biotechnology (14 patents) Heterocyclic Building Blocks (12 patents) Organometallic Reagents (1 patents) Peptides & Amino Acids (1 patents)

Technical Specifications

Molecular FormulaC18H19BN2O4S
Molecular Weight370.11584 g/mol
XLogP1.3864
Topological Polar Surface Area (TPSA)98.3 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors6
Rotatable Bonds5
Exact Mass370.11584 Da
Heavy Atoms26
Complexity566.0
SMILESB(C1=CC(=CC=C1)NS(=O)(=O)C2=CC=CC3=C2C=CC=C3N(C)C)(O)O
InChIKeyTYXMKSYBCDTGDU-UHFFFAOYSA-N

Product Description

Applications: FluoroBora I is used in pharmaceutical synthesis routes and API production, as well as biotechnology workflows and life-science research. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

FluoroBora I is a pharmaceutical intermediate identified by CAS number 75806-94-9 and the molecular formula C18H19BN2O4S and a molecular weight of 370.12 g/mol. Synonyms include 3-(Dansylamino)phenylboronic acid and FluoroBora I.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of FluoroBora I

XLogP
1.3864
TPSA (Topological Polar Surface Area)
98.3
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
6
Rotatable Bonds
5
Heavy Atoms
26
Complexity
566.0
Exact Mass
370.11584
Monoisotopic Mass
370.11584
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 FluoroBora I

The XLogP value of 1.3864 suggests moderate lipophilicity, balancing water solubility and membrane permeability for FluoroBora I. The TPSA of 98.3 Ų falls within the moderate polarity range, balancing permeability and solubility for FluoroBora I. Following Lipinski's Rule of Five, FluoroBora I has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of FluoroBora I?

The CAS number of FluoroBora I is 75806-94-9.

What is the molecular formula of FluoroBora I?

The molecular formula of FluoroBora I is C18H19BN2O4S.

What is the molecular weight of FluoroBora I?

The molecular weight of FluoroBora I is 370.11584 g/mol.

What are the applications of FluoroBora I?

FluoroBora I is used in pharmaceutical synthesis routes and API production, as well as biotechnology workflows and life-science research. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton...

Where can I buy FluoroBora I?

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

Does CoreyChem offer custom synthesis for FluoroBora I?

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

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