Mapa
Also known as methyl 3-oxo-2-phenylbutanoate, methyl alpha-acetylphenylacetate, Methyl 2-phenylacetoacetate
Key facts
What buyers check first
- CAS number
- 16648-44-5
- Formula
- C11H12O3
- Molar mass
- 192.21 g/mol
- HS code
- 291830
- Category
- Aromatic building blocks
What is Mapa?
Plain description, key identifiers and synonyms
Mapa is a chemical substance with the molecular formula C11H12O3 and a molar mass of 192.21 g/mol. Its CAS registry number is 16648-44-5. The IUPAC name is methyl 3-oxo-2-phenylbutanoate.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- methyl 3-oxo-2-phenylbutanoate
- CAS number
- 16648-44-5
- Molecular formula
- C11H12O3
- UNII
- 2TG7ZF9DBT
- MDL number
- MFCD21881652
- InChIKey
- CYSACHQWYQYLIG-UHFFFAOYSA-N
- InChI
- InChI=1S/C11H12O3/c1-8(12)10(11(13)14-2)9-6-4-3-5-7-9/h3-7,10H,1-2H3
- SMILES (canonical and isomeric)
- CC(=O)C(C1=CC=CC=C1)C(=O)OC
Synonyms
- methyl 3-oxo-2-phenylbutanoate
- methyl alpha-acetylphenylacetate
- Methyl 2-phenylacetoacetate
- Benzeneacetic acid, a-acetyl-, methyl ester
- methyl alpha-phenylacetoacetate
- Benzeneacetic acid, alpha-acetyl-, methyl ester
- methyl 3-oxo-2-phenyl-butanoate
- Methyl a-phenylacetoacetate (MAPA)
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 | 192.21 g/molcalc.Computed value |
|---|---|
| Exact mass | 192.0786 Dacalc.Computed value |
| LogP (octanol/water) | 1.53calc.Computed value |
| Topological polar surface area | 43.37 Ųcalc.Computed value |
| Hydrogen bond donors | 0calc.Computed value |
| Hydrogen bond acceptors | 3calc.Computed value |
| Rotatable bonds | 3calc.Computed value |
| Heavy atoms | 14calc.Computed value |
| Rings | 1calc.Computed value |
| Aromatic rings | 1calc.Computed value |
| Fraction sp3 carbons | 0.27calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 1calc.Computed value |
| Lipinski rule of five | Passes (0 violations)calc.Computed value |
Calculated for screening. Confirm critical figures with the supplier.
Murcko scaffold
The ring system that remains when every side chain is removed
Safety and hazards
GHS classification summary, not a safety data sheet
No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.
GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.
Mapa suppliers
Controlled substance, listings of documented suppliers only, in the documented ranking
Mapa is controlled. Only documented suppliers can list it, and buyers must upload a valid licence with their request. Every request is reviewed before suppliers see it.
Methyl alpha-phenylacetoacetate (MAPA)
Reference: UN 1988 Convention, Table I
Our policy on controlled substancesLicensed buyers can post a request for Mapa with their licence. Our compliance team reviews it before suppliers see it.
Mapa 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
Regulatory status
Inventories, regulations and trade controls that list this substance
Mapa is controlled. Only documented suppliers can list it, and buyers must upload a valid licence with their request. Every request is reviewed before suppliers see it.
Methyl alpha-phenylacetoacetate (MAPA)
Reference: UN 1988 Convention, Table I
Our policy on controlled substancesHS code and trade data
Customs classification and reported world trade statistics
Global trade
World import and export statistics for the HS code Mapa 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 Mapa is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Mapa, based on the data on this page
What is Mapa?
What is the CAS number of Mapa?
What is the molecular formula and weight of Mapa?
What is Mapa used for?
Is Mapa hazardous?
What is the HS code of Mapa?
Can I buy Mapa on CompoundList?
Guides for buyers
Practical guides that help when you source, ship or handle Mapa
- Guide, Chemical identityCAS registry numbers explainedWhat a CAS number identifies, how the check digit works, why one chemical can have several numbers and what a CAS number cannot tell you about a product.Read
- Guide, Trade and logisticsHS codes for chemicals and why they matterHow the Harmonized System classifies chemicals, the chapters that matter, the rules for chemically defined compounds and mixtures, and practical steps to find the right code.Read
- Guide, RegulationImporting chemicals into India: documents and complianceThe registrations, import policy checks, product specific licences, duties and documents you need to import chemicals into India, step by step.Read
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