Methyl isonipecotate - ≥98% , CAS No.2971-79-1

CAS: 2971-79-1 Cat. No.: I135762 Molecular Weight: 143.19 Beilstein Registry Number: 22(4)128 EC Number: 629-683-9
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
AM20090394 | Methyl piperidine-4-carboxylate; Methyl 4-piperidinecarboxylate; 4-Piperidinecarboxylic acid methyl ester;Methyl piperidine-4-carboxylate | A820022 | SCHEMBL5163 | methyl 4-piperidinylcarboxylate | J-522626 | Isonipecotic acid methvl ester |
Storage
Argon charged,Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
25ml
I135762-25ml
2
$18.90
100ml
I135762-100ml
4
$47.90
500ml
I135762-500ml
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$173.90
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Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Argon charged,Room temperature Ships Normal Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Overview

Reactant for C-2 arylation of piperidines through directed transition metal-catalyzed sp3 C-H activation Reactant for synthesis of: Antitubercular agents Anti-HIV-1 agents Aminopyrazine inhibitors Orally available naphthyridine protein kinase D inhibitors A Scalable catalyst from asymmetric hydrogenation of sterically demanding aryl enamide

Specifications

Synonyms
AM20090394 | Methyl piperidine-4-carboxylate; Methyl 4-piperidinecarboxylate; 4-Piperidinecarboxylic acid methyl ester;Methyl piperidine-4-carboxylate | A820022 | SCHEMBL5163 | methyl 4-piperidinylcarboxylate | J-522626 | Isonipecotic acid methvl ester |
Specifications & Purity
≥98%
Storage
Argon charged, Room temperature
Shipped In
Normal
Purity
≥98%
Names and Identifiers
Pubchem Sid488189713
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488189713
Canonical SmilesCOC(=O)C1CCNCC1
IUPAC Namemethyl piperidine-4-carboxylate
InChIKeyRZVWBASHHLFBJF-UHFFFAOYSA-N
INCHI1S/C7H13NO2/c1-10-7(9)6-2-4-8-5-3-6/h6,8H,2-5H2,1H3
Isomeric SMILES COC(=O)C1CCNCC1
Molecular Weight 143.19
Beilstein 22(4)128
Reaxy-Rn 114975
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=114975&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

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📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassPiperidines
SubclassPiperidinecarboxylic acids and derivatives
Intermediate Tree Nodes Not available
Direct ParentPiperidinecarboxylic acids
Alternative Parents Methyl esters  Amino acids and derivatives  Monocarboxylic acids and derivatives  Dialkylamines  Azacyclic compounds  Organopnictogen compounds  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic heteromonocyclic compounds
Substituents Piperidinecarboxylic acid - Methyl ester - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Secondary amine - Azacycle - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Amine - Organic oxygen compound - Organopnictogen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Aliphatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as piperidinecarboxylic acids. These are compounds containing a piperidine ring which bears a carboxylic acid group.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





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.

13 results found

Lot NumberCertificate TypeDateItem
H2519281Certificate of AnalysisAug 06, 2025 I135762
H2519282Certificate of AnalysisAug 06, 2025 I135762
H2519662Certificate of AnalysisAug 06, 2025 I135762
E1831094Certificate of AnalysisOct 17, 2023 I135762
K2126501Certificate of AnalysisSep 20, 2023 I135762
K2126502Certificate of AnalysisSep 20, 2023 I135762
K2126503Certificate of AnalysisSep 20, 2023 I135762
K2427178Certificate of AnalysisSep 20, 2023 I135762
D1720057Certificate of AnalysisOct 21, 2022 I135762
J22181064Certificate of AnalysisJul 21, 2022 I135762
J2218873Certificate of AnalysisJul 21, 2022 I135762
J2218894Certificate of AnalysisJul 21, 2022 I135762
E1831095Certificate of AnalysisMay 06, 2022 I135762

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Chemical and Physical Properties
Solubilitysoluble in water
SensitivityAir sensitive
Refractive Index1.465
Flash Point(°F)192.2℉
Flash Point(°C)89°C(lit.)
Boil Point(°C)93 °C
Molecular Weight143.180 g/mol
XLogP3-0.400
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass143.095 Da
Monoisotopic Mass143.095 Da
Topological Polar Surface Area38.300 Ų
Heavy Atom Count10
Formal Charge0
Complexity119.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
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