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Methyl allyl disulfide - 90%, high purity , CAS No.2179-58-0

COA

Grade & Purity:

≥90%

Cas Number: 2179-58-0
Molecular Weight: 120.24
MDL number: MFCD00040023
PubChem CID: 62434

In stock

Item Number

M103119

Grouped product items
SKU	Size	Availability	Price	Qty
M103119-5g	5g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$128.90
M103119-25g	25g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$577.90

View related series

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

Basic Description

Synonyms	CHEBI:6854 \| D88486 \| DISULFIDE, METHYL-2-PROPENYL \| 3-(Methyldisulfanyl)-1-propene \| DTXSID60176199 \| FEMA 3127 \| SCHEMBL548935 \| ALLYL METHYL DISULFIDE [FHFI] \| ALLYL METHYL DISULFIDE \| 3-(Methyldisulfanyl)-1-propene # \| ALLYLMETHYLDISULFIDE \| Methyl 2-
Specifications & Purity	≥90%
Storage Temp	Store at 2-8°C,Protected from light,Argon charged
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organosulfur compounds
  - Class Allyl sulfur compounds

Kingdom	Organic compounds
Superclass	Organosulfur compounds
Class	Allyl sulfur compounds
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Allyl sulfur compounds
Alternative Parents	Dialkyldisulfides Sulfenyl compounds Hydrocarbon derivatives
Molecular Framework	Aliphatic acyclic compounds
Substituents	Allyl sulfur compound - Dialkyldisulfide - Organic disulfide - Sulfenyl compound - Hydrocarbon derivative - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as allyl sulfur compounds. These are compounds containing an allylsulfur group, with the general structure H2C(=CH2)CS.
External Descriptors	organic disulfide
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	3-(methyldisulfanyl)prop-1-ene
INCHI	InChI=1S/C4H8S2/c1-3-4-6-5-2/h3H,1,4H2,2H3
InChIKey	XNZOTQPMYMCTBZ-UHFFFAOYSA-N
Smiles	CSSCC=C
Isomeric SMILES	CSSCC=C
UN Number	1993
Molecular Weight	120.24
Reaxy-Rn	2070522
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2070522&ln=

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

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

Analytical Chart:

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5 results found

Lot Number	Certificate Type	Date	Item
D2514023	Certificate of Analysis	May 10, 2025	M103119
E2323971	Certificate of Analysis	Jan 22, 2025	M103119
E23231261	Certificate of Analysis	Jan 22, 2025	M103119
K2127675	Certificate of Analysis	Sep 14, 2023	M103119
C2112297	Certificate of Analysis	Dec 13, 2022	M103119

Chemical and Physical Properties

Sensitivity	Air sensitive;Heat sensitive;Light sensitive
Refractive Index	1.53
Flash Point(°F)	35°C(lit.)
Flash Point(°C)	35°C(lit.)
Molecular Weight	120.200 g/mol
XLogP3	1.600
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	120.007 Da
Monoisotopic Mass	120.007 Da
Topological Polar Surface Area	50.600 Å²
Heavy Atom Count	6
Formal Charge	0
Complexity	34.500
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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