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2,4-Butanesultone - >98.0%(GC), high purity , CAS No.1121-03-5

1 Citations

COA

Grade & Purity:

≥98%(GC)

Cas Number: 1121-03-5
Molecular Weight: 136.17
PubChem CID: 70716
PubChem SID: 504754559

In stock

Item Number

B152088

Grouped product items
SKU	Size	Availability	Price
B152088-250mg	250mg	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$11.90
B152088-25g	25g	1	$877.90
B152088-5g	5g	2	$195.90

Basic Description

Synonyms	2,4-Butanesultone \| 1121-03-5 \| 3-Methyl-1,2-oxathiolane 2,2-dioxide \| 3-methyloxathiolane 2,2-dioxide \| 4-Hydroxy-2-butanesulfonic acid gamma-sultone \| 1,2-Oxathiolane, 3-methyl-, 2,2-dioxide \| 3-Methyl-1,2-oxathiolane2,2-dioxide \| BRN 0110592 \| 2,4-butane sultone \| EINEC
Specifications & Purity	≥98%(GC)
Storage Temp	Store at 2-8°C,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 Organoheterocyclic compounds
  - Class Oxathiolanes
    - Subclass Gamma sultones

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Oxathiolanes
Subclass	Gamma sultones
Intermediate Tree Nodes	Not available
Direct Parent	Gamma sultones
Alternative Parents	Sulfonic acid esters Organosulfonic acid esters Oxacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aliphatic heteromonocyclic compounds
Substituents	Gamma-sultone - Organosulfonic acid ester - Sulfonic acid ester - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Oxacycle - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aliphatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as gamma sultones. These are organic compounds containing a gamma-sultone, a Intramolecular cyclic ester of hydroxy sulfonic acid, with a SO ring bond, and three ring carbon atoms.
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

Pubchem Sid	504754559
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504754559
IUPAC Name	3-methyloxathiolane 2,2-dioxide
INCHI	InChI=1S/C4H8O3S/c1-4-2-3-7-8(4,5)6/h4H,2-3H2,1H3
InChIKey	VWEYDBUEGDKEHC-UHFFFAOYSA-N
Smiles	CC1CCOS1(=O)=O
Isomeric SMILES	CC1CCOS1(=O)=O
RTECS	RP5480000
Molecular Weight	136.17
Reaxy-Rn	110592
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=110592&ln=

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

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

Analytical Chart:

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8 results found

Lot Number	Certificate Type	Date	Item
H2307340	Certificate of Analysis	Jul 21, 2023	B152088
H2307333	Certificate of Analysis	Jul 21, 2023	B152088
H2307156	Certificate of Analysis	Jul 21, 2023	B152088
H2307350	Certificate of Analysis	Jul 21, 2023	B152088
H2307154	Certificate of Analysis	Jul 21, 2023	B152088
H2307153	Certificate of Analysis	Jul 21, 2023	B152088
G2226208	Certificate of Analysis	Jun 13, 2022	B152088
G2226218	Certificate of Analysis	Jun 13, 2022	B152088

Chemical and Physical Properties

Sensitivity	Heat sensitive;Moisture sensitive
Flash Point(°F)	93°C(lit.)
Flash Point(°C)	93°C
Boil Point(°C)	150°C/12mmHg(lit.)
Molecular Weight	136.170 g/mol
XLogP3	0.200
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	136.019 Da
Monoisotopic Mass	136.019 Da
Topological Polar Surface Area	51.800 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	164.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
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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