Skip to the beginning of the images gallery

Sodium 1-butanethiolate - 95%, high purity , CAS No.4779-86-6

COA

Grade & Purity:

≥95%

Cas Number: 4779-86-6
Molecular Weight: 112.17
PubChem CID: 3530993

In stock

Item Number

S330722

Grouped product items
SKU	Size	Availability	Price
S330722-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$99.90
S330722-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$282.90
S330722-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$459.90

View related series

Sodium salt (54) Thiols (34)

Basic Description

Synonyms	SCHEMBL1148854 \| sodium thiobutoxide \| sodium;butane-1-thiolate \| VTLWRSNWWLIJTQ-UHFFFAOYSA-M \| 1-Butanethiolsodium salt \| 1-Butanethiol sodium salt \| 1-Butanethiol, sodium salt \| 1-Butanethiol, sodium salt (1:1) \| Sodium 1-butanethiolate, technical, >=95
Specifications & Purity	≥95%
Storage Temp	Room temperature,Argon charged
Shipped In	Normal
Product Description	In contrast to the stenchy gaseous or liquid thiols, the salts are easy to handle solids.; Salts of alkanethiols are versatile intermediates for the synthesis of various thiol esters and thioethers. Alkanethiolates are strong nucleophiles and thus efficient reagents for SN2 type dealkylations of hindered esters and lactones. Cleavage of aryl methyl ethers.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic salts
  - Class Organic metal salts
    - Subclass Organic alkali metal salts

Kingdom	Organic compounds
Superclass	Organic salts
Class	Organic metal salts
Subclass	Organic alkali metal salts
Intermediate Tree Nodes	Not available
Direct Parent	Organic alkali metal salts
Alternative Parents	Organosulfur compounds Organic sodium salts Hydrocarbon derivatives Organic cations
Molecular Framework	Aliphatic acyclic compounds
Substituents	Organic alkali metal salt - Hydrocarbon derivative - Organic sodium salt - Organosulfur compound - Organic cation - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as organic alkali metal salts. These are organic salts of an alkali metal. The alkali metal atom is usually in its ionic form.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	sodium;butane-1-thiolate
INCHI	InChI=1S/C4H10S.Na/c1-2-3-4-5;/h5H,2-4H2,1H3;/q;+1/p-1
InChIKey	VTLWRSNWWLIJTQ-UHFFFAOYSA-M
Smiles	CCCC[S-].[Na+]
Isomeric SMILES	CCCC[S-].[Na+]
WGK Germany	3
PubChem CID	3530993
UN Number	3263
Packing Group	III
Molecular Weight	112.17

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

6 results found

Lot Number	Certificate Type	Date	Item
D2530349	Certificate of Analysis	Apr 23, 2025	S330722
D2530350	Certificate of Analysis	Apr 23, 2025	S330722
D2530351	Certificate of Analysis	Apr 23, 2025	S330722
D2530352	Certificate of Analysis	Apr 23, 2025	S330722
D2530353	Certificate of Analysis	Apr 23, 2025	S330722
D2530354	Certificate of Analysis	Apr 23, 2025	S330722

Chemical and Physical Properties

Sensitivity	Moisture sensitive
Molecular Weight	112.170 g/mol
XLogP3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	112.032 Da
Monoisotopic Mass	112.032 Da
Topological Polar Surface Area	1.000 Å²
Heavy Atom Count	6
Formal Charge	0
Complexity	17.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	2

Solution Calculators

Molarity Calculator

Determine the necessary mass, volume, or concentration for preparing a solution.

Mass

Concentration

Volume

M. Wt*

g/mol

*When preparing stock solutions, always use the batch-specific molecular weight of the product found on the vial label and the Certificate of Analysis (available online).

Dilution Calculator

Determine the dilution needed to prepare a stock solution.

Concentration 1 (C1)

Volume 1 (V1)

Concentration 2 (C2)

Volume 2 (V2)

Reconstitution Calculator

The reconstitution calculator enables you to quickly determine the volume of a reagent needed to reconstitute your vial. Just enter the mass of the reagent and the target concentration, and the calculator will do the rest.

Volume (to add to vial)

Mass (in vial)

Desired Reconstitution Concentration