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Choline hydrogen sulfate structure
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Choline hydrogen sulfate

TL;DR: Choline hydrogen sulfate (CAS 16655-25-7) is a chemical compound with molecular formula C5H14NO4S+ and molecular weight 184.06436 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

trimethyl(2-sulfooxyethyl)azanium

Also Known As: choline hydrogen sulfate, Sulfocholine, choline sulfate, trimethyl(2-sulfooxyethyl)azanium, N,N,N-trimethyl-2-(sulfooxy)ethanaminium

CAS Number
16655-25-7
Molecular Formula
C5H14NO4S+
Molecular Weight
184.06436 g/mol
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Application Areas

Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (5 patents) Analytical Reagents (2 patents) Biotechnology (23 patents) Dyes & Pigments (4 patents) Food Additives (8 patents)

Technical Specifications

Molecular FormulaC5H14NO4S+
Molecular Weight184.06436 g/mol
XLogP-0.8
Topological Polar Surface Area (TPSA)72.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors4
Rotatable Bonds4
Exact Mass184.06436 Da
Heavy Atoms11
Complexity198.0
SMILESC[N+](C)(C)CCOS(=O)(=O)O
InChIKeyWXCQAWGXWVRCGP-UHFFFAOYSA-O

Product Description

Applications: Choline hydrogen sulfate 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. CoreyChem supplies Choline hydrogen sulfate (CAS 16655-25-7) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

A pharmaceutical intermediate supplied by CoreyChem, Choline hydrogen sulfate (CAS 16655-25-7) has the molecular formula C5H14NO4S+ and a molecular weight of 184.06 g/mol. It is also known as choline hydrogen sulfate and Sulfocholine.

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 Choline hydrogen sulfate

XLogP
-0.8
TPSA (Topological Polar Surface Area)
72.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
4
Rotatable Bonds
4
Heavy Atoms
11
Complexity
198.0
Exact Mass
184.06436
Monoisotopic Mass
184.06436
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 Choline hydrogen sulfate

The XLogP value of -0.8 indicates that Choline hydrogen sulfate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 72.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Choline hydrogen sulfate. Following Lipinski's Rule of Five, Choline hydrogen sulfate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Choline hydrogen sulfate?

The CAS number of Choline hydrogen sulfate is 16655-25-7.

What is the molecular formula of Choline hydrogen sulfate?

The molecular formula of Choline hydrogen sulfate is C5H14NO4S+.

What is the molecular weight of Choline hydrogen sulfate?

The molecular weight of Choline hydrogen sulfate is 184.06436 g/mol.

What are the applications of Choline hydrogen sulfate?

Choline hydrogen sulfate 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. CoreyChem supplies Choline hydrogen sulfate (CAS 16655-25-7) with custom...

Where can I buy Choline hydrogen sulfate?

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

Does CoreyChem offer custom synthesis for Choline hydrogen sulfate?

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

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