2-Bromoethyl ether - CAS 5414-19-7
Catalog: |
BB028520 |
Product Name: |
2-Bromoethyl ether |
CAS: |
5414-19-7 |
Synonyms: |
1-bromo-2-(2-bromoethoxy)ethane |
IUPAC Name: | 1-bromo-2-(2-bromoethoxy)ethane |
Description: | 2-Bromoethyl ether (CAS# 5414-19-7) is used as a reagent in the synthesis of AZD 3147, a selective dual inhibitor of mTORC1 and mTORC2. Bis(2-bromoethyl) Ether is also used in the preparation of (2S)-2-Amino-3-(4-morpholin-4-ylphenyl)propanoic Acid (A618690); an impurity of Melphalan (M216900) which is an antineoplastic. |
Molecular Weight: | 231.91 |
Molecular Formula: | C4H8Br2O |
Canonical SMILES: | C(CBr)OCCBr |
InChI: | InChI=1S/C4H8Br2O/c5-1-3-7-4-2-6/h1-4H2 |
InChI Key: | FOZVXADQAHVUSV-UHFFFAOYSA-N |
Boiling Point: | 92-93 °C (12 mmHg) |
Purity: | 98 % |
Density: | 1.845 g/cm3 |
Appearance: | Colourless liquid |
Storage: | Pure form, -20°C, 3 years; 4°C, 2 years; In solvent, -80°C, 6 months; -20°C, 1 month |
MDL: | MFCD00039196 |
LogP: | 1.79280 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
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PMID | Publication Date | Title | Journal |
12074650 | 20020627 | An amino alcohol ligand for highly enantioselective addition of organozinc reagents to aldehydes: serendipity rules | Organic letters |
Complexity: | 28.9 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 231.89214 |
Formal Charge: | 0 |
Heavy Atom Count: | 7 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 229.89419 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 9.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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