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Methylsuccinic anhydride - 98%, high purity , CAS No.4100-80-5

1 Citations

COA

Grade & Purity:

≥98%

Cas Number: 4100-80-5
Molecular Weight: 114.1
EC Number: 223-870-5
MDL number: MFCD00005527
PubChem CID: 20051
PubChem SID: 504752955

In stock

Item Number

M102626

Grouped product items
SKU	Size	Availability	Price
M102626-5g	5g	3	$107.90
M102626-25g	25g	3	$361.90
M102626-100g	100g	3	$1,225.90
M102626-500g	500g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$5,514.90

Basic Description

Synonyms	EINECS 223-870-5 \| NSC 65437 \| Methylsuccinicanhydride \| Q27159753 \| 3-methyloxolane-2,5-dione \| AI3-11208 \| Methylsuccinic anhydride \| methyl-succinic anhydride \| MFCD00005527 \| NSC43978 \| NSC-43978 \| AKOS009157111 \| 3-Methyldihydro-2,5-furandione # \| FT
Specifications & Purity	≥98%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic acids and derivatives
  - Class Carboxylic acids and derivatives
    - Subclass Dicarboxylic acids and derivatives

Kingdom	Organic compounds
Superclass	Organic acids and derivatives
Class	Carboxylic acids and derivatives
Subclass	Dicarboxylic acids and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Dicarboxylic acids and derivatives
Alternative Parents	Tetrahydrofurans Carboxylic acid anhydrides Lactones Oxacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aliphatic heteromonocyclic compounds
Substituents	Dicarboxylic acid or derivatives - Tetrahydrofuran - Carboxylic acid anhydride - Lactone - Oxacycle - Organoheterocyclic compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as dicarboxylic acids and derivatives. These are organic compounds containing exactly two carboxylic acid groups.
External Descriptors	cyclic dicarboxylic anhydride - tetrahydrofurandione
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	504752955
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504752955
IUPAC Name	3-methyloxolane-2,5-dione
INCHI	InChI=1S/C5H6O3/c1-3-2-4(6)8-5(3)7/h3H,2H2,1H3
InChIKey	DFATXMYLKPCSCX-UHFFFAOYSA-N
Smiles	CC1CC(=O)OC1=O
Isomeric SMILES	CC1CC(=O)OC1=O
WGK Germany	3
Molecular Weight	114.1
Reaxy-Rn	80816
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=80816&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.

6 results found

Lot Number	Certificate Type	Date	Item
E2113248	Certificate of Analysis	Feb 07, 2025	M102626
E2113250	Certificate of Analysis	Feb 07, 2025	M102626
E2227284	Certificate of Analysis	Mar 19, 2022	M102626
E2227140	Certificate of Analysis	Mar 19, 2022	M102626
E2227291	Certificate of Analysis	Mar 19, 2022	M102626
E2227287	Certificate of Analysis	Mar 19, 2022	M102626

Chemical and Physical Properties

Sensitivity	Moisture sensitive
Boil Point(°C)	238-240°C
Melt Point(°C)	33-35°C
Molecular Weight	114.100 g/mol
XLogP3	0.100
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	114.032 Da
Monoisotopic Mass	114.032 Da
Topological Polar Surface Area	43.400 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	139.000
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

Citations of This Product

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