1-Bromononane - CAS 693-58-3
Catalog: |
BB033789 |
Product Name: |
1-Bromononane |
CAS: |
693-58-3 |
Synonyms: |
1-bromononane |
IUPAC Name: | 1-bromononane |
Description: | 1-Bromononane (CAS# 693-58-3) is a useful synthetic intermediate. It is used in the synthesis of cyclooxygenase-2 (COX-2), a new class of selective COX-2 inactivators. It is also used to prepare alkylimidazoles by N-alkylation of imidazoles as antibacterial agents. |
Molecular Weight: | 207.15 |
Molecular Formula: | C9H19Br |
Canonical SMILES: | CCCCCCCCCBr |
InChI: | InChI=1S/C9H19Br/c1-2-3-4-5-6-7-8-9-10/h2-9H2,1H3 |
InChI Key: | AYMUQTNXKPEMLM-UHFFFAOYSA-N |
Boiling Point: | 201 °C |
Density: | 1.084 g/cm3 |
Appearance: | Colorless to pale yellow clear liquid |
MDL: | MFCD00000278 |
LogP: | 4.13190 |
GHS Hazard Statement: | H400 (97.62%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard] |
Precautionary Statement: | P273, P391, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113024417-A | Method and device for strengthening separation in isocyanate preparation | 20210527 |
CN-113024417-B | Method and device for strengthening separation in isocyanate preparation | 20210527 |
CN-112645971-A | Method for directly preparing alkyl borate compound from alkyl halide | 20210120 |
CN-112679723-A | Two-end alkyl terminated PAG polyether and preparation method thereof | 20201228 |
CN-112779391-A | Quenching liquid containing both-end alkyl terminated PAG polyether and preparation method thereof | 20201228 |
PMID | Publication Date | Title | Journal |
22969507 | 20120901 | N-Acetyl-3,5-dibromo-l-tyrosine hemihydrate | Acta crystallographica. Section E, Structure reports online |
22701860 | 20120401 | The role of tiotropium in the management of asthma | Asia Pacific allergy |
22199836 | 20111201 | 5-Chloro-1-nonyl-1H-benzimidazol-2(3H)-one | Acta crystallographica. Section E, Structure reports online |
21522418 | 20110219 | 5-Nitro-1-nonyl-1H-benzimidazol-2(3H)-one | Acta crystallographica. Section E, Structure reports online |
21522975 | 20110108 | 1-Nonyl-1H-benzimidazol-2(3H)-one | Acta crystallographica. Section E, Structure reports online |
Complexity: | 52.7 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 206.06701 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 206.06701 |
Rotatable Bond Count: | 7 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 5.4 |
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