Mesaconic acid
Also known as 2-Methylfumaric acid, 2-Butenedioic acid, 2-methyl-, (2E)-, Fumaric acid, methyl-
Key facts
What buyers check first
- CAS number
- 498-24-8
- Formula
- C5H6O4
- Molar mass
- 130.10 g/mol
- EC number
- 207-859-2
- HS code
- 291719
- Category
- Carboxylic acids and anhydrides
What is Mesaconic acid?
Plain description, key identifiers and synonyms
Mesaconic acid is a dicarboxylic acid consisting of fumaric acid having a methyl substituent at the 2-position. It has a role as a plant metabolite and a human metabolite. It is a dicarboxylic fatty acid and a dicarboxylic acid. It is functionally related to a fumaric acid. It is a conjugate acid of a mesaconate(2-).
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- (E)-2-methylbut-2-enedioic acid
- CAS number
- 498-24-8 CAS number cross-checkedOther or deprecated CAS: 498-23-7
- EC number
- 207-859-2
- Molecular formula
- C5H6O4
- UNII
- 90UTM639KK
- MDL number
- MFCD00002653
- InChIKey
- HNEGQIOMVPPMNR-NSCUHMNNSA-N
- InChI
- InChI=1S/C5H6O4/c1-3(5(8)9)2-4(6)7/h2H,1H3,(H,6,7)(H,8,9)/b3-2+
- Canonical SMILES
- CC(=CC(=O)O)C(=O)O
- Isomeric SMILES
- C/C(=C\C(=O)O)/C(=O)O
Synonyms
- 2-Methylfumaric acid
- 2-Butenedioic acid, 2-methyl-, (2E)-
- Fumaric acid, methyl-
- (2E)-2-Methylbut-2-enedioic acid
- Citronic acid
- (E)-2-methylbut-2-enedioic acid
- trans-2-Methyl-2-butenedioic acid
- trans-1-Propene-1,2-dicarboxylic acid
- Kyselina mesakonova
- Butenedioic acid, methyl-, (E)-
- 2-Butenedioic acid, 2-methyl-, (E)-
- (E)-Citraconic acid
- 2-methyl-2E-butenedioic acid
- (2E)-2-Methyl-2-butenedioic acid
- 4-02-00-02231 (Beilstein Handbook Reference)
- 2-Butenedioic acid, 2-methyl-, (E)-(9CI)
- Methylfumaric acid
- mesaconate
- 2-methylbut-2-enedioic acid
- (E)-2-Methyl-2-butenedioic acid
- 2-methylfumarate
- (E)-Citraconate
- methylfumarate
- (E)-2-methyl-but-2-enedioic acid
- Citronate
Show all 34 synonymsShow fewer synonyms
- Mesaconic acid, 99%
- (2E)-2-Methyl
- trans-2-Methyl-2-butenedioate
- (2E)-2-Methyl-2-butenedioate
- Mesaconic acid, mesaconate
- trans-1-Propene-1,2-dicarboxylate
- (2E)-2-Methyl-2-butenedioic acid #
- 2-Butenedioic acid, 2-methyl-, (E)- (9CI)
- FB1827E3-2A34-43A5-BDDC-481FC6606513
Physical and chemical properties
Measured values and descriptors computed from the structure
Physical and chemical properties
Measured values, check the supplier specification for your grade
No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.
Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.
Computed descriptors
Calculated from the structure, useful for screening and formulation
| Molecular weight | 130.10 g/molcalc.Computed value |
|---|---|
| Exact mass | 130.0266 Dacalc.Computed value |
| LogP (octanol/water) | 0.1calc.Computed value |
| Topological polar surface area | 74.6 Ųcalc.Computed value |
| Hydrogen bond donors | 2calc.Computed value |
| Hydrogen bond acceptors | 2calc.Computed value |
| Rotatable bonds | 2calc.Computed value |
| Heavy atoms | 9calc.Computed value |
| Rings | 0calc.Computed value |
| Aromatic rings | 0calc.Computed value |
| Fraction sp3 carbons | 0.2calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 0calc.Computed value |
| Lipinski rule of five | Passes (0 violations)calc.Computed value |
Calculated for screening. Confirm critical figures with the supplier.
Safety and hazards
GHS classification summary, not a safety data sheet
Hazard statements
- H315Causes skin irritation.
- H319Causes serious eye irritation.
- H335May cause respiratory irritation.
Precautionary statements (16)
- P261Avoid breathing dust, fume, gas, mist, vapours or spray.
- P264Wash skin thoroughly after handling.
- P264 + P265Wash skin thoroughly after handling. Do not touch eyes.
- P271Use only outdoors or in a well-ventilated area.
- P280Wear protective gloves, protective clothing, eye protection and face protection.
- P302 + P352If on skin: Wash with plenty of water.
- P304 + P340If inhaled: Remove person to fresh air and keep comfortable for breathing.
- P305 + P351 + P338If in eyes: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
- P319Get medical help if you feel unwell.
- P321Specific treatment (see supplemental first aid instructions on the label).
- P332 + P317If skin irritation occurs: Get medical help.
- P337 + P317If eye irritation persists: Get medical help.
- P362 + P364Take off contaminated clothing. And wash it before reuse.
- P403 + P233Store in a well-ventilated place. Keep container tightly closed.
- P405Store locked up.
- P501Dispose of contents and container in accordance with local regulations.
GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.
Full safety data and first aidMesaconic acid suppliers
Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings
- ChinaUnclaimed profileMesaconic acidGrade, purity and minimum order on requestPrice on request
- Ukraine, KievUnclaimed profileMesaconic acidGrade, purity and minimum order on requestPrice on request
- United States, ElginUnclaimed profileMesaconic acidGrade, purity and minimum order on requestPrice on request
- Hong Kong, CentralUnclaimed profileMesaconic acidGrade, purity and minimum order on requestPrice on request
Suppliers marked Unclaimed profile have not claimed their profile yet. They are not verified by CompoundList, their offers are price on request and details may have changed, so please confirm them with the supplier. Company representatives can claim a profile with a business email on the company's own website domain. Our team verifies each claim and sends the result by email.
Where suppliers are based
4 suppliers in 4 countries
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Mesaconic acid price
Indicative price range per kg from live supplier offers
Suppliers quote this chemical on request. Send one free request and compare quotes side by side.
Uses and applications
What the substance is used for, by industry and function
Industries and functions
Roles
- animal metabolite
- eukaryotic metabolite
- human metabolite
- mammalian metabolite
- metabolite
- plant metabolite
Regulatory status
Inventories, regulations and trade controls that list this substance
United States
- TSCA inventory (USA)Status: Active in US commerce
HS code and trade data
Customs classification and reported world trade statistics
Global trade
World import and export statistics for the HS code Mesaconic acid is traded under.
Acyclic polycarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and…
- China46.6%
- United States13.7%
- Germany10.1%
- United States16.2%
- Denmark11.8%
- Germany10.0%
The HS code shown for Mesaconic acid is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Mesaconic acid, based on the data on this page
What is Mesaconic acid?
What is the CAS number of Mesaconic acid?
What is the molecular formula and weight of Mesaconic acid?
What is Mesaconic acid used for?
Is Mesaconic acid hazardous?
What is the HS code of Mesaconic acid?
Where can I buy Mesaconic acid?
What is the price of Mesaconic acid?
Guides for buyers
Practical guides that help when you source, ship or handle Mesaconic acid
- Guide, SafetyHow to read a safety data sheet in 10 minutesA section by section method to pull the essentials out of any 16 section SDS: identity, hazards, composition, storage, PPE, properties, transport and emergency measures.Read
- Guide, SafetyGHS pictograms, signal words and hazard statements explainedA practical guide to the nine GHS pictograms, the signal words Danger and Warning, H and P statements, and how to read a chemical label in seconds.Read
- Article, SourcingHow to write an RFQ that gets fast and accurate quotesWhat suppliers need to quote quickly and comparably: exact product identity, quantity and packing, delivery terms, documents, samples and payment, with a ready to use template.Read
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