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2-{1,4-dioxaspiro[4.5]decan-8-yl}ethan-1-ol - 97%, high purity , CAS No.135761-76-1
Basic Description
| Synonyms | MFCD07779436 | PS-16698 | 2-(1,4-dioxaspiro[4.5]decan-8-yl)ethanol | 1,4-Dioxaspiro[4.5]decane-8-ethanol | 2-(1,4-Dioxa-spiro[4.5]dec-8-yl)ethanol | 2-(1,4-Dioxa-spiro[4.5]dec-8-yl)-ethanol | 2-(1,4-Dioxaspiro[4.5]dec-8-yl)ethanol | 2-(1,4-Dioxaspiro[4.5] |
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| Specifications & Purity | ≥97% |
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| Shipped In | Normal |
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Names and Identifiers
| IUPAC Name | 2-(1,4-dioxaspiro[4.5]decan-8-yl)ethanol |
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| INCHI | InChI=1S/C10H18O3/c11-6-3-9-1-4-10(5-2-9)12-7-8-13-10/h9,11H,1-8H2 |
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| InChi Key | TXUGEISFHODXQL-UHFFFAOYSA-N |
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| Canonical SMILES | C1CC2(CCC1CCO)OCCO2 |
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| Isomeric SMILES | C1CC2(CCC1CCO)OCCO2 |
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| Alternate CAS | 135761-76-1 |
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| PubChem CID | 11805458 |
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| Molecular Weight | 186.25 |
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Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
| Molecular Weight | 186.250 g/mol |
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| XLogP3 | 0.800 |
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| Hydrogen Bond Donor Count | 1 |
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| Hydrogen Bond Acceptor Count | 3 |
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| Rotatable Bond Count | 2 |
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| Exact Mass | 186.126 Da |
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| Monoisotopic Mass | 186.126 Da |
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| Topological Polar Surface Area | 38.700 Ų |
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| Heavy Atom Count | 13 |
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| Formal Charge | 0 |
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| Complexity | 154.000 |
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| Isotope Atom Count | 0 |
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| Defined Atom Stereocenter Count | 0 |
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| Undefined Atom Stereocenter Count | 0 |
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| Defined Bond Stereocenter Count | 0 |
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| Undefined Bond Stereocenter Count | 0 |
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| The total count of all stereochemical bonds | 0 |
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| Covalently-Bonded Unit Count | 1 |
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Safety and Hazards(GHS)
| Pictogram(s) | GHS07 |
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| Signal | Warning |
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| Hazard Statements | H302:Harmful if swallowed |
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| Precautionary Statements | P501:Dispose of contents/container to ... P264:Wash hands [and …] thoroughly after handling. P270:Do not eat, drink or smoke when using this product. P330:Rinse mouth. P301+P312:IF SWALLOWED: call a POISON CENTER/doctor/... IF you feel unwell. |
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