1-[(benzyloxy)carbonyl]-5,5-difluoropiperidine-3-carboxylic acid - ≥97% , CAS No.1356338-81-2

CAS: 1356338-81-2 Cat. No.: B173537 Molecular Weight: 299.274
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Synonyms
1-((benzyloxy)carbonyl)-5,5-difluoropiperidine-3-carboxylic acid | AMY34567 | AS-54021 | 1356338-81-2 | EN300-23704159 | 1-(Benzyloxycarbonyl)-5,5-difluoropiperidine-3-carboxylic acid | SCHEMBL14636079 | AKOS037644580 | SB22004 | P17410 | 1-[(benzyloxy)ca
Storage
Room temperature
Shipped In
Normal
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Size
Status
Price
Qty
1g
B173537-1g
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$349.90

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Why this grade

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

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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
1-((benzyloxy)carbonyl)-5, 5-difluoropiperidine-3-carboxylic acid | AMY34567 | AS-54021 | 1356338-81-2 | EN300-23704159 | 1-(Benzyloxycarbonyl)-5, 5-difluoropiperidine-3-carboxylic acid | SCHEMBL14636079 | AKOS037644580 | SB22004 | P17410 | 1-[(benzyloxy)ca
Specifications & Purity
≥97%
Storage
Room temperature
Shipped In
Normal
Purity
≥97%
Names and Identifiers
Canonical SmilesC1C(CN(CC1(F)F)C(=O)OCC2=CC=CC=C2)C(=O)O
IUPAC Name5,5-difluoro-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid
InChIKeyAICPFFSPPXEEKL-UHFFFAOYSA-N
INCHI1S/C14H15F2NO4/c15-14(16)6-11(12(18)19)7-17(9-14)13(20)21-8-10-4-2-1-3-5-10/h1-5,11H,6-9H2,(H,18,19)
Isomeric SMILES C1C(CN(CC1(F)F)C(=O)OCC2=CC=CC=C2)C(=O)O
Molecular Weight 299.274
Reaxy-Rn 39551834
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=39551834&ln=

Documentation

📋 Safety Data Sheet (SDS)

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

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✅ 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
SuperclassBenzenoids
ClassBenzene and substituted derivatives
SubclassBenzyloxycarbonyls
Intermediate Tree Nodes Not available
Direct ParentBenzyloxycarbonyls
Alternative Parents Piperidinecarboxylic acids  Carbamate esters  Monocarboxylic acids and derivatives  Carboxylic acids  Azacyclic compounds  Organonitrogen compounds  Organofluorides  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  Alkyl fluorides  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Benzyloxycarbonyl - Piperidinecarboxylic acid - Piperidine - Carbamic acid ester - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Azacycle - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as benzyloxycarbonyls. These are organic compounds containing a carbonyl group substituted with a benzyloxyl 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 Weight299.270 g/mol
XLogP32.000
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass299.097 Da
Monoisotopic Mass299.097 Da
Topological Polar Surface Area66.800 Ų
Heavy Atom Count21
Formal Charge0
Complexity396.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
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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