5-(2-Bromoethyl)-2,2-dimethyl-1,3-dioxane - CAS 97845-58-4
Catalog: |
BB042073 |
Product Name: |
5-(2-Bromoethyl)-2,2-dimethyl-1,3-dioxane |
CAS: |
97845-58-4 |
Synonyms: |
5-(2-bromoethyl)-2,2-dimethyl-1,3-dioxane |
IUPAC Name: | 5-(2-bromoethyl)-2,2-dimethyl-1,3-dioxane |
Description: | 5-(2-Bromoethyl)-2,2-dimethyl-1,3-dioxane (CAS# 97845-58-4) is a useful research chemical. |
Molecular Weight: | 223.11 |
Molecular Formula: | C8H15BrO2 |
Canonical SMILES: | CC1(OCC(CO1)CCBr)C |
InChI: | InChI=1S/C8H15BrO2/c1-8(2)10-5-7(3-4-9)6-11-8/h7H,3-6H2,1-2H3 |
InChI Key: | QFLUXIUZRCNNHY-UHFFFAOYSA-N |
Boiling Point: | 239.2 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.255 g/cm3 |
Appearance: | Liquid |
Storage: | Inert atmosphere, Store in freezer, under -20 °C |
MDL: | MFCD06411062 |
LogP: | 2.17050 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
AU-2014243837-A1 | Combined systemic and topical treatment of disordered tissues | 20130314 |
CN-105188693-A | Combined systemic and topical treatment of disordered tissues | 20130314 |
EP-2968228-A1 | Combined systemic and topical treatment of disordered tissues | 20130314 |
JP-2016517419-A | Combined systemic and local treatment of damaged tissue | 20130314 |
KR-20160005331-A | Combined systemic and topical treatment of disordered tissues | 20130314 |
PMID | Publication Date | Title | Journal |
3040998 | 19870901 | Synthesis and antiviral activity of 9-[4-hydroxy-3-(hydroxymethyl)but-1-yl]purines | Journal of medicinal chemistry |
Complexity: | 115 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 222.02554 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 222.02554 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 18.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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