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Thiocyanate structure
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Thiocyanate

TL;DR: Thiocyanate (CAS 302-04-5) is a chemical compound with molecular formula CNS- and molecular weight 57.975143 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

thiocyanate

Also Known As: thiocyanate, Thiocyanate ion, Isothiocyanate, Rhodanide, thiocyanic acid

CAS Number
302-04-5
Molecular Formula
CNS-
Molecular Weight
57.975143 g/mol
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Technical Specifications

Molecular FormulaCNS-
Molecular Weight57.975143 g/mol
XLogP0.6
Topological Polar Surface Area (TPSA)24.8 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds0
Exact Mass57.975143 Da
Heavy Atoms3
Complexity31.0
SMILESC(#N)[S-]
InChIKeyZMZDMBWJUHKJPS-UHFFFAOYSA-M

Product Description

Applications: Thiocyanate is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Thiocyanate (CAS 302-04-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

A fine chemical supplied by CoreyChem, Thiocyanate (CAS 302-04-5) has the molecular formula CNS- and a molecular weight of 57.98 g/mol. It is also known as thiocyanate and Thiocyanate ion.

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 Thiocyanate

XLogP
0.6
TPSA (Topological Polar Surface Area)
24.8
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
0
Heavy Atoms
3
Complexity
31.0
Exact Mass
57.975143
Monoisotopic Mass
57.975143
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 Thiocyanate

The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thiocyanate. With a topological polar surface area (TPSA) of 24.8 Ų, Thiocyanate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thiocyanate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Thiocyanate?

The CAS number of Thiocyanate is 302-04-5.

What is the molecular formula of Thiocyanate?

The molecular formula of Thiocyanate is CNS-.

What is the molecular weight of Thiocyanate?

The molecular weight of Thiocyanate is 57.975143 g/mol.

What are the applications of Thiocyanate?

Thiocyanate is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Thiocyanate (CAS 302-04-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS...

Where can I buy Thiocyanate?

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

Does CoreyChem offer custom synthesis for Thiocyanate?

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

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