4-Bromo-2-fluorobenzaldehyde - CAS 57848-46-1
Catalog: |
BB029845 |
Product Name: |
4-Bromo-2-fluorobenzaldehyde |
CAS: |
57848-46-1 |
Synonyms: |
4-bromo-2-fluorobenzaldehyde |
IUPAC Name: | 4-bromo-2-fluorobenzaldehyde |
Description: | 4-Bromo-2-fluorobenzaldehyde (CAS# 57848-46-1) is used in the synthesis of Nigeglanine hydrobromide. |
Molecular Weight: | 203.01 |
Molecular Formula: | C7H4BrFO |
Canonical SMILES: | C1=CC(=C(C=C1Br)F)C=O |
InChI: | InChI=1S/C7H4BrFO/c8-6-2-1-5(4-10)7(9)3-6/h1-4H |
InChI Key: | UPCARQPLANFGQJ-UHFFFAOYSA-N |
Boiling Point: | 241.4 °C at 760 mmHg |
Melting Point: | 59-64 °C |
Purity: | 98 % |
Density: | 1.67 g/cm3 |
Appearance: | Lightyellowtobeigecrystal |
MDL: | MFCD00143261 |
LogP: | 2.40070 |
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, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113200970-A | Osthole isoxazoline derivatives, and preparation method and application thereof | 20210426 |
CN-112812781-A | Bipiperazine benzoxazole-based liquid crystal compound and preparation method thereof | 20210121 |
US-2021298295-A1 | Compounds and compositions for nematode treatment | 20200221 |
WO-2021154966-A1 | Compounds and compositions for use in treating skin disorders | 20200129 |
CN-112608320-A | Piperidine compound and preparation method and medical application thereof | 20200116 |
PMID | Publication Date | Title | Journal |
21431183 | 20110507 | Synthesis of tri-substituted biaryl based trianglimines: formation of C3-symmetrical and non-symmetrical regioisomers | Organic & biomolecular chemistry |
16099661 | 20051215 | Dicationic near-linear biphenyl benzimidazole derivatives as DNA-targeted antiprotozoal agents | Bioorganic & medicinal chemistry |
Complexity: | 129 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 201.94296 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 201.94296 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 17.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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