2-Bromo-3-fluorobenzaldehyde - CAS 891180-59-9
Catalog: |
BB039348 |
Product Name: |
2-Bromo-3-fluorobenzaldehyde |
CAS: |
891180-59-9 |
Synonyms: |
2-bromo-3-fluorobenzaldehyde; 2-bromo-3-fluorobenzaldehyde |
IUPAC Name: | 2-bromo-3-fluorobenzaldehyde |
Description: | 2-Bromo-3-fluorobenzaldehyde (CAS# 891180-59-9) is a useful research chemical for organic synthesis and other chemical processes. |
Molecular Weight: | 203.01 |
Molecular Formula: | C7H4BrFO |
Canonical SMILES: | C1=CC(=C(C(=C1)F)Br)C=O |
InChI: | InChI=1S/C7H4BrFO/c8-7-5(4-10)2-1-3-6(7)9/h1-4H |
InChI Key: | CYJBMGYWRHGZBR-UHFFFAOYSA-N |
Boiling Point: | 227.4 °C at 760 mmHg |
Density: | 1.67 g/cm3 |
Appearance: | Solid |
MDL: | MFCD07782044 |
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 |
WO-2021169963-A1 | Aromatic compound and use thereof in preparing antineoplastic drugs | 20200224 |
CN-112159405-A | Pyridopyrimidinone compounds and application thereof | 20200204 |
CN-112159405-B | Pyridopyrimidinone compounds and application thereof | 20200204 |
WO-2021155716-A1 | Pyridopyrimidinone compound and application thereof | 20200204 |
WO-2021063276-A1 | Macrocyclic derivative, preparation method therefor and use thereof | 20190930 |
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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