1-tert-butyl 4-methyl 4-methylpiperidine-1,4-dicarboxylate - ≥97% , CAS No.724790-59-4

CAS: 724790-59-4 Cat. No.: T177287 Molecular Weight: 257.33 PubChem CID: 46318388
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Synonyms
METHYL1-BOC-4-METHYLPIPERIDINE-4-CARBOXYLATE | 4-methyl-piperidine-1,4-dicarboxylic acid 1-tert-butyl ester 4-methyl ester | 4-Methylpiperidine-1,4-dicarboxylic acid 1-tert-butyl ester 4-methyl ester | SY004854 | SNBGURLVYHVYEB-UHFFFAOYSA-N | 1-tert-Butyl
Storage
Room temperature
Shipped In
Normal
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Size
Status
Price
Qty
1g
T177287-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$78.90

$118.90
Save $40.00 (33.64%)
5g
T177287-5g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$95.90

$143.90
Save $48.00 (33.36%)
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Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

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.

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Literature proof

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

Specifications

Synonyms
METHYL1-BOC-4-METHYLPIPERIDINE-4-CARBOXYLATE | 4-methyl-piperidine-1, 4-dicarboxylic acid 1-tert-butyl ester 4-methyl ester | 4-Methylpiperidine-1, 4-dicarboxylic acid 1-tert-butyl ester 4-methyl ester | SY004854 | SNBGURLVYHVYEB-UHFFFAOYSA-N | 1-tert-Butyl
Specifications & Purity
≥97%
Storage
Room temperature
Shipped In
Normal
Purity
≥97%
Names and Identifiers
Canonical SmilesCC1(CCN(CC1)C(=O)OC(C)(C)C)C(=O)OC
IUPAC Name1-O-tert-butyl 4-O-methyl 4-methylpiperidine-1,4-dicarboxylate
InChIKeySNBGURLVYHVYEB-UHFFFAOYSA-N
INCHI1S/C13H23NO4/c1-12(2,3)18-11(16)14-8-6-13(4,7-9-14)10(15)17-5/h6-9H2,1-5H3
Isomeric SMILES CC1(CCN(CC1)C(=O)OC(C)(C)C)C(=O)OC
PubChem CID 46318388
Molecular Weight 257.33

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.

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🔬 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  Carbamate esters  Tertiary amines  Monocarboxylic acids and derivatives  Azacyclic compounds  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic heteromonocyclic compounds
Substituents Piperidinecarboxylic acid - Carbamic acid ester - Methyl ester - Amino acid or derivatives - Carboxylic acid ester - Tertiary amine - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Organooxygen compound - Organonitrogen compound - Amine - Organic oxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - 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:
Chemical and Physical Properties
Molecular Weight257.329 g/mol
XLogP31.800
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass257.163 Da
Monoisotopic Mass257.163 Da
Topological Polar Surface Area55.800 Ų
Heavy Atom Count18
Formal Charge0
Complexity324.000
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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