![2-[(9R)-9-(Pyridin-2-Yl)-6-Oxaspiro[4.5]Decan-9-Yl]Acetonitrile - ≥99% CAS No(1401031-38-6) by Aladdin Scientific](https://www.aladdinsci.com/media/catalog/product/cache/207e23213cf636ccdef205098cf3c8a3/D/6/D691223.jpg)
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2-[(9R)-9-(Pyridin-2-Yl)-6-Oxaspiro[4.5]Decan-9-Yl]Acetonitrile - ≥99% , CAS No.1401031-38-6
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GRADE & PURITY ≥99%
Storage
Room temperature
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Why this grade
≥99% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Storage & shipping
Room temperature Ships Check lot-specific COA for exact specifications.
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
Specifications & Purity
≥99%
Storage
Room temperature
Purity
≥99%
Names and Identifiers
| Canonical Smiles | C1CCC2(C1)CC(CCO2)(CC#N)C3=CC=CC=N3 |
|---|---|
| IUPAC Name | 2-[(9R)-9-pyridin-2-yl-6-oxaspiro[4.5]decan-9-yl]acetonitrile |
| InChIKey | AJVYDBCIZBRGAK-OAHLLOKOSA-N |
| INCHI | 1S/C16H20N2O/c17-10-8-15(14-5-1-4-11-18-14)9-12-19-16(13-15)6-2-3-7-16/h1,4-5,11H,2-3,6-9,12-13H2/t15-/m1/s1 |
| Isomeric SMILES | C1CCC2(C1)C[C@](CCO2)(CC#N)C3=CC=CC=N3 |
| PubChem CID | 68314099 |
| Molecular Weight | 256.339 |
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 →🔬 Specification Sheet
Full quality attributes and acceptance criteria for this grade.
View spec sheet →Advanced Data
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 Weight | 256.339 g/mol |
|---|---|
| XLogP3 | 2.100 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 256.158 Da |
| Monoisotopic Mass | 256.158 Da |
| Topological Polar Surface Area | 45.900 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 366.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
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