2-Oxoadipic acid
Also known as 2-Oxohexanedioic acid, Oxoadipic acid, alpha-Ketoadipic acid
Key facts
What buyers check first
- CAS number
- 3184-35-8
- Formula
- C6H8O5
- Molar mass
- 160.13 g/mol
- EC number
- 636-531-5
- HS code
- 291830
- Category
- Carboxylic acids and anhydrides
What is 2-Oxoadipic acid?
Plain description, key identifiers and synonyms
2-oxoadipic acid is an oxo dicarboxylic acid that is adipic acid substituted by an oxo group at position 2. It has a role as a mouse metabolite and a human urinary metabolite. It is functionally related to an adipic acid. It is a conjugate acid of a 2-oxoadipate(2-).
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- 2-oxohexanedioic acid
- CAS number
- 3184-35-8 CAS number cross-checked
- EC number
- 636-531-5
- Molecular formula
- C6H8O5
- UNII
- BB72FKL1M2
- MDL number
- MFCD00010004
- InChIKey
- FGSBNBBHOZHUBO-UHFFFAOYSA-N
- InChI
- InChI=1S/C6H8O5/c7-4(6(10)11)2-1-3-5(8)9/h1-3H2,(H,8,9)(H,10,11)
- SMILES (canonical and isomeric)
- C(CC(=O)C(=O)O)CC(=O)O
Synonyms
- 2-Oxohexanedioic acid
- Oxoadipic acid
- alpha-Ketoadipic acid
- 2-oxoadipate
- 2-Ketoadipic acid
- Hexanedioic acid, 2-oxo-
- 2-ketoadipate
- alpha-Oxoadipic acid
- alpha-ketoadipate
- 2-keto-adipate
- 2-oxohexanedionic acid
- 2-Oxo-hexanedioic acid
- Oxoadipate
- a-oxoadipic acid
- 2-Oxoadipic acid, 98
- Oxoadipicacid
- a-Ketoadipate
- a-Oxoadipate
- alpha-ketodipate
- alpha-Oxoadipate
- a-Ketoadipic acid
- 2-Oxo-hexanedioate
- OOG
- 2-Oxohexanedioicacid
- alpha-keto-adipic acid
Show all 30 synonymsShow fewer synonyms
- 2-Oxohexanedioic acid #
- Oxoadipic acid (Standard)
- Fgsbnbbhozhubo-uhfffaoysa-
- 2-Oxoadipic acid, >=95.0% (HPLC)
- Hexanedioic acid, 2-oxo- (7CI,8CI,9CI)
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 | 160.13 g/molcalc.Computed value |
|---|---|
| Exact mass | 160.0372 Dacalc.Computed value |
| LogP (octanol/water) | -0.11calc.Computed value |
| Topological polar surface area | 91.67 Ųcalc.Computed value |
| Hydrogen bond donors | 2calc.Computed value |
| Hydrogen bond acceptors | 3calc.Computed value |
| Rotatable bonds | 5calc.Computed value |
| Heavy atoms | 11calc.Computed value |
| Rings | 0calc.Computed value |
| Aromatic rings | 0calc.Computed value |
| Fraction sp3 carbons | 0.5calc.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.
Precautionary statements (9)
- P264Wash skin thoroughly after handling.
- P264 + P265Wash skin thoroughly after handling. Do not touch eyes.
- P280Wear protective gloves, protective clothing, eye protection and face protection.
- P302 + P352If on skin: Wash with plenty of water.
- P305 + P351 + P338If in eyes: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
- 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.
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 aid2-Oxoadipic acid suppliers
Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings
- India, Ankleshwar ManufacturerUnclaimed profile2-Oxoadipic acidGrade, purity and minimum order on requestPrice on request
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Where suppliers are based
1 supplier in 1 country
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2-Oxoadipic 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
- human urinary metabolite
- mammalian metabolite
- metabolite
- mouse metabolite
Regulatory status
Inventories, regulations and trade controls that list this substance
No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.
HS code and trade data
Customs classification and reported world trade statistics
Global trade
World import and export statistics for the HS code 2-Oxoadipic acid is traded under.
Carboxylic acids with aldehyde or ketone function but without other oxygen function…
- China43.3%
- India * partner reported10.4%
- United States6.8%
* Partner reported figures, a lower bound.
The HS code shown for 2-Oxoadipic acid is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about 2-Oxoadipic acid, based on the data on this page
What is 2-Oxoadipic acid?
What is the CAS number of 2-Oxoadipic acid?
What is the molecular formula and weight of 2-Oxoadipic acid?
What is 2-Oxoadipic acid used for?
Is 2-Oxoadipic acid hazardous?
What is the HS code of 2-Oxoadipic acid?
Where can I buy 2-Oxoadipic acid?
Where can I buy 2-Oxoadipic acid in India?
What is the price of 2-Oxoadipic acid?
Guides for buyers
Practical guides that help when you source, ship or handle 2-Oxoadipic 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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