Basic Description

Synonyms	1,3,2lambda-dioxathiane-2,2-dione \| MFCD00801144 \| CID 16218650 \| BRN 0774775 \| D4427 \| W-108753 \| 1,3,2-DIOXATHIANE2,2-DIOXIDE \| BS-30033 \| PROPYLENE SULPHATE, 1,3- \| Q27290765 \| F20412 \| 1,3,2-dioxathiane-2,2-dione \| EINECS 214-022-5 \| SY052762 \| 1,3-Pr
Specifications & Purity	≥98%
Storage Temp	Argon charged
Shipped In	Normal
Product Description	Bacillus sp. CCZU11-1 catalyzed biotransformation of 1,3-propanediol cyclic sulfate (1,3-PDS) and its derivatives has been proposed. It can undergo biocatalyzed transformation to diols by Rhodococcus sp. Application 1,3-Propanediol cyclic sulfate may be used for the synthesis of substituted (p-aminostyryl)-1-(3-sulfooxypropyl)pyridinium (ASSP) inner salts.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic acids and derivatives
  - Class Organic sulfuric acids and derivatives
    - Subclass Sulfuric acid esters

Kingdom	Organic compounds
Superclass	Organic acids and derivatives
Class	Organic sulfuric acids and derivatives
Subclass	Sulfuric acid esters
Intermediate Tree Nodes	Not available
Direct Parent	Sulfuric acid diesters
Alternative Parents	Dioxathiolanes Alkyl sulfates Oxacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aliphatic heteromonocyclic compounds
Substituents	Sulfuric acid diester - Alkyl sulfate - Dioxathiolane - Oxacycle - Organoheterocyclic compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aliphatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as sulfuric acid diesters. These are organic compounds containing the sulfuric acid diester functional group with the generic structure ROS(OR')(=O)=O, (R,R'=organyl group).
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	488184559
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488184559
IUPAC Name	1,3,2-dioxathiane 2,2-dioxide
INCHI	InChI=1S/C3H6O4S/c4-8(5)6-2-1-3-7-8/h1-3H2
InChIKey	OQYOVYWFXHQYOP-UHFFFAOYSA-N
Smiles	C1COS(=O)(=O)OC1
Isomeric SMILES	C1COS(=O)(=O)OC1
WGK Germany	3
RTECS	TY4560000
Molecular Weight	138.14
Reaxy-Rn	774775
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=774775&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.

12 results found

Lot Number	Certificate Type	Date	Item
G2501587	Certificate of Analysis	Jun 16, 2025	P120337
G2501588	Certificate of Analysis	Jun 16, 2025	P120337
E2410204	Certificate of Analysis	May 16, 2024	P120337
E2410210	Certificate of Analysis	May 15, 2024	P120337
A2508100	Certificate of Analysis	May 15, 2024	P120337
L2222038	Certificate of Analysis	Dec 09, 2022	P120337
L2222040	Certificate of Analysis	Dec 09, 2022	P120337
L2222046	Certificate of Analysis	Dec 09, 2022	P120337
L2222041	Certificate of Analysis	Dec 09, 2022	P120337
L2222069	Certificate of Analysis	Dec 09, 2022	P120337
L2222068	Certificate of Analysis	Dec 09, 2022	P120337
C2221017	Certificate of Analysis	Mar 31, 2022	P120337

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Chemical and Physical Properties

Melt Point(°C)	58-62°C
Molecular Weight	138.140 g/mol
XLogP3	-0.200
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	0
Exact Mass	137.999 Da
Monoisotopic Mass	137.999 Da
Topological Polar Surface Area	61.000 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	141.000
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	1

Citations of This Product

How to Cite Aladdin Scientific Products?

1. Bo Pang, Fujun Cui, Wanting Chen, Xiaozhou Wang, Ruohan Du, Xuemei Wu, Xiaoming Yan, Yan Dai, Gaohong He. (2022) Construction of hierarchical proton sieving-conductive channels in sulfated UIO-66 grafted polybenzimidazole ion conductive membrane for vanadium redox flow battery. JOURNAL OF POWER SOURCES, 526 (231132).
2. Bo Pang, Qi Zhang, Xiaoming Yan, Xiaozhou Wang, Wanting Chen, Ruohan Du, Xuemei Wu, Minggang Guo, Gaohong He, Fujun Cui. (2021) Superior acidic sulfate ester group based high conductive membrane for vanadium redox flow battery. JOURNAL OF POWER SOURCES, 506 (230203).

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SKU	Size	Availability	Price
P120337-1g	1g	5	$9.90
P120337-5g	5g	2	$19.90
P120337-25g	25g	1	$59.90

1,3-Propanediol cyclic sulfate - 98%, high purity , CAS No.1073-05-8