(4S,4'S)-2,2'-Cyclopentylidenebis[4,5-dihydro-4-(phenylmethyl)oxazole] - ≥97%,≥99%(ee) , CAS No.1003886-05-2

CAS: 1003886-05-2 Cat. No.: S281571 Molecular Weight: 388.5 PubChem CID: 24746421
AVAILABLE TO ORDER
GRADE & PURITY ≥97%,≥99%(ee)
Storage
Store at 2-8°C
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
50mg
S281571-50mg
3

$33.90

$57.90
Save $24.00 (41.45%)
100mg
S281571-100mg
3

$56.90

$102.90
Save $46.00 (44.70%)
250mg
S281571-250mg
3

$128.90

$230.90
Save $102.00 (44.17%)
1g
S281571-1g
3

$485.90

$831.90
Save $346.00 (41.59%)
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Why this grade

≥97%,≥99%(ee) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C Ships Wet ice 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

Specifications & Purity
≥97%, ≥99%(ee)
Legal Information
Sold in collaboration with Daicel for research purposes only.
Storage
Store at 2-8°C
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Purity
≥97%, ≥99%(ee)
Names and Identifiers
Pubchem Sid504769801
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504769801
Canonical SmilesC1CCC(C1)(C2=NC(CO2)CC3=CC=CC=C3)C4=NC(CO4)CC5=CC=CC=C5
IUPAC Name(4S)-4-benzyl-2-[1-[(4S)-4-benzyl-4,5-dihydro-1,3-oxazol-2-yl]cyclopentyl]-4,5-dihydro-1,3-oxazole
InChIKeyRSBSWYBZVIWBOP-VXKWHMMOSA-N
INCHI1S/C25H28N2O2/c1-3-9-19(10-4-1)15-21-17-28-23(26-21)25(13-7-8-14-25)24-27-22(18-29-24)16-20-11-5-2-6-12-20/h1-6,9-12,21-22H,7-8,13-18H2/t21-,22-/m0/s1
Isomeric SMILES C1CCC(C1)(C2=N[C@H](CO2)CC3=CC=CC=C3)C4=N[C@H](CO4)CC5=CC=CC=C5
PubChem CID 24746421
Molecular Weight 388.5

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
SuperclassBenzenoids
ClassBenzene and substituted derivatives
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentBenzene and substituted derivatives
Alternative Parents Oxazolines  Imidoesters  Propargyl-type 1,3-dipolar organic compounds  Oxacyclic compounds  Azacyclic compounds  Organopnictogen compounds  Organooxygen compounds  Organonitrogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Monocyclic benzene moiety - Oxazoline - Imido ester - Oxacycle - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.
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.

5 results found

Lot NumberCertificate TypeDateItem
C2317042Certificate of AnalysisJan 19, 2026 S281571
C2317050Certificate of AnalysisJan 19, 2026 S281571
C2317094Certificate of AnalysisJan 19, 2026 S281571
C2317107Certificate of AnalysisJan 19, 2026 S281571
C2317135Certificate of AnalysisJan 19, 2026 S281571
Chemical and Physical Properties
Boil Point(°C)524.0±33.0 °C
Molecular Weight388.500 g/mol
XLogP34.900
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass388.215 Da
Monoisotopic Mass388.215 Da
Topological Polar Surface Area43.200 Ų
Heavy Atom Count29
Formal Charge0
Complexity562.000
Isotope Atom Count0
Defined Atom Stereocenter Count2
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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