potassium;(3-tert-butoxycarbonyl-3-azabicyclo[4.1.0]heptan-6-yl)-trifluoro-boranuide - ≥97% , CAS No.2095504-46-2

CAS: 2095504-46-2 Cat. No.: P631590 Molecular Weight: 303.17 EC Number: 853-658-3 PubChem CID: 132352786
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Synonyms
EN300-7546698 | potassium(3-(tert-butoxycarbonyl)-3-azabicyclo[4.1.0]heptan-6-yl)trifluoroborate | 2095504-46-2 | VID50446 | potassium;(3-tert-butoxycarbonyl-3-azabicyclo[4.1.0]heptan-6-yl)-trifluoro-boranuide | SY269865 | potassium {3-[(tert-butoxy)carbo
Storage
Room temperature
Shipped In
Normal
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100mg
P631590-100mg
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250mg
P631590-250mg
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500mg
P631590-500mg
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1g
P631590-1g
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5g
P631590-5g
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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.

📚

Literature proof

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

Specifications

Synonyms
EN300-7546698 | potassium(3-(tert-butoxycarbonyl)-3-azabicyclo[4.1.0]heptan-6-yl)trifluoroborate | 2095504-46-2 | VID50446 | potassium;(3-tert-butoxycarbonyl-3-azabicyclo[4.1.0]heptan-6-yl)-trifluoro-boranuide | SY269865 | potassium {3-[(tert-butoxy)carbo
Specifications & Purity
≥97%
Storage
Room temperature
Shipped In
Normal
Purity
≥97%
Names and Identifiers
Canonical Smiles[B-](C12CCN(CC1C2)C(=O)OC(C)(C)C)(F)(F)F.[K+]
IUPAC Namepotassium;trifluoro-[3-[(2-methylpropan-2-yl)oxycarbonyl]-3-azabicyclo[4.1.0]heptan-6-yl]boranuide
InChIKeyDDXOCWAAULENJK-UHFFFAOYSA-N
INCHI1S/C11H18BF3NO2.K/c1-10(2,3)18-9(17)16-5-4-11(12(13,14)15)6-8(11)7-16;/h8H,4-7H2,1-3H3;/q-1;+1
Isomeric SMILES [B-](C12CCN(CC1C2)C(=O)OC(C)(C)C)(F)(F)F.[K+]
Alternate CAS 2095504-46-2
PubChem CID 132352786
Molecular Weight 303.17

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.

Look up COA →

📊 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 Azepanes  Carbamate esters  Organic carbonic acids and derivatives  Boronic acid derivatives  Alkylhaloboranes  Organic metalloid salts  Organic metal halides  Azacyclic compounds  Organopnictogen compounds  Organooxygen compounds  Organonitrogen compounds  Organic potassium salts  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAliphatic heteropolycyclic compounds
Substituents Piperidinecarboxylic acid - Azepane - Carbamic acid ester - Alkylhaloborane - Carbonic acid derivative - Boronic acid derivative - Organic metal halide - Azacycle - Organic alkali metal salt - Organic metalloid salt - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic potassium salt - Organic salt - Organooxygen compound - Organonitrogen compound - Organoboron compound - Aliphatic heteropolycyclic 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 Weight303.170 g/mol
XLogP3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass303.102 Da
Monoisotopic Mass303.102 Da
Topological Polar Surface Area29.500 Ų
Heavy Atom Count19
Formal Charge0
Complexity372.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count2
Solution Calculators
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