2-Bromoallyl alcohol - CAS 598-19-6
Catalog: |
BB030516 |
Product Name: |
2-Bromoallyl alcohol |
CAS: |
598-19-6 |
Synonyms: |
2-bromoprop-2-en-1-ol |
IUPAC Name: | 2-bromoprop-2-en-1-ol |
Description: | 2-Bromoallyl alcohol (CAS# 598-19-6) is a useful research chemical. |
Molecular Weight: | 136.98 |
Molecular Formula: | C3H5BrO |
Canonical SMILES: | C=C(CO)Br |
InChI: | InChI=1S/C3H5BrO/c1-3(4)2-5/h5H,1-2H2 |
InChI Key: | MDFFZNIQPLKQSG-UHFFFAOYSA-N |
Boiling Point: | 58-62 °C / 100 mbar |
Density: | 1.654 g/cm3 |
Appearance: | Colorless to brown liquid |
MDL: | MFCD09265077 |
LogP: | 0.88730 |
GHS Hazard Statement: | H302 (97.5%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
US-2021174983-A1 | Compositions for the filling of high aspect ratio vertical interconnect access (via) holes | 20191204 |
WO-2021112933-A1 | Compositions for the filling of high aspect ratio vertical interconnect access (via) holes | 20191204 |
WO-2020139742-A1 | Brominated flame retardants and polyurethanes containing the same | 20181227 |
CN-113227188-A | Brominated flame retardants and polyurethanes containing the same | 20181227 |
KR-20210110614-A | Brominated flame retardant and polyurethane containing same | 20181227 |
PMID | Publication Date | Title | Journal |
12939138 | 20030902 | Haloalkane dehalogenase LinB from Sphingomonas paucimobilis UT26: X-ray crystallographic studies of dehalogenation of brominated substrates | Biochemistry |
Complexity: | 42.2 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 135.95238 |
Formal Charge: | 0 |
Heavy Atom Count: | 5 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 135.95238 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 20.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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