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Ethyl Propyl Sulfide - ≥96.0%(GC), high purity , CAS No.4110-50-3

COA

Grade & Purity:

≥96%(GC)

Cas Number: 4110-50-3
Molecular Weight: 104.21
Beilstein Registry Number: 1(4)1451
MDL number: MFCD00039940
PubChem CID: 20063

In stock

Item Number

E134963

Grouped product items
SKU	Size	Availability	Price
E134963-5g	5g	3	$69.90
E134963-25g	25g	2	$241.90
E134963-100g	100g	3	$817.90

View related series

Non heterocyclic block (8163) Sulfur containing compounds (986)

Basic Description

Synonyms	Ethyl propyl sulfide \| LS-13098 \| SCHEMBL200623 \| EINECS 223-890-4 \| Sulfide, ethyl propyl \| Q27259528 \| 1-ethylsulfanylpropane \| Ethyl n-propyl sulfide \| Ethyl propyl sulphide \| Propyl ethyl sulfide \| NSC163319 \| NSC-163319 \| UNII-4FK48S87VH \| NSC 163319
Specifications & Purity	≥96%(GC)
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organosulfur compounds
  - Class Thioethers
    - Subclass Dialkylthioethers

Kingdom	Organic compounds
Superclass	Organosulfur compounds
Class	Thioethers
Subclass	Dialkylthioethers
Intermediate Tree Nodes	Not available
Direct Parent	Dialkylthioethers
Alternative Parents	Sulfenyl compounds Hydrocarbon derivatives
Molecular Framework	Aliphatic acyclic compounds
Substituents	Dialkylthioether - Sulfenyl compound - Hydrocarbon derivative - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as dialkylthioethers. These are organosulfur compounds containing a thioether group that is substituted by two alkyl groups.
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	1-ethylsulfanylpropane
INCHI	InChI=1S/C5H12S/c1-3-5-6-4-2/h3-5H2,1-2H3
InChIKey	ZDDDFDQTSXYYSE-UHFFFAOYSA-N
Smiles	CCCSCC
Isomeric SMILES	CCCSCC
Molecular Weight	104.21
Beilstein	1(4)1451
Reaxy-Rn	1730935
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1730935&ln=

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.

3 results found

Lot Number	Certificate Type	Date	Item
J2213731	Certificate of Analysis	Jul 16, 2024	E134963
J2213713	Certificate of Analysis	Jul 16, 2024	E134963
J2213714	Certificate of Analysis	Jul 16, 2024	E134963

Chemical and Physical Properties

Flash Point(°C)	19 °C
Boil Point(°C)	117 °C
Molecular Weight	104.220 g/mol
XLogP3	2.100
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Exact Mass	104.066 Da
Monoisotopic Mass	104.066 Da
Topological Polar Surface Area	25.300 Å²
Heavy Atom Count	6
Formal Charge	0
Complexity	19.900
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	1

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