3-Fluoro-4-nitrobenzaldehyde - CAS 160538-51-2
Catalog: |
BB011641 |
Product Name: |
3-Fluoro-4-nitrobenzaldehyde |
CAS: |
160538-51-2 |
Synonyms: |
3-fluoro-4-nitrobenzaldehyde; 3-fluoro-4-nitrobenzaldehyde |
IUPAC Name: | 3-fluoro-4-nitrobenzaldehyde |
Description: | 3-Fluoro-4-nitrobenzaldehyde (CAS# 160538-51-2) is a useful research chemical. |
Molecular Weight: | 169.11 |
Molecular Formula: | C7H4FNO3 |
Canonical SMILES: | C1=CC(=C(C=C1C=O)F)[N+](=O)[O-] |
InChI: | InChI=1S/C7H4FNO3/c8-6-3-5(4-10)1-2-7(6)9(11)12/h1-4H |
InChI Key: | BWUIGISQVCIQBT-UHFFFAOYSA-N |
Boiling Point: | 312 °C at 760 mmHg |
Density: | 1.443 g/cm3 |
MDL: | MFCD00968940 |
LogP: | 2.06960 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112266328-A | Synthetic route and preparation method of 3-fluoro-4-nitrobenzaldehyde | 20201209 |
CN-111848599-A | Oxygen-containing five-membered heterocyclic compound, synthesis method, pharmaceutical composition and application | 20200428 |
WO-2021203016-A2 | Protein-protein interaction stabilizers | 20200403 |
WO-2021188948-A1 | Mdm2 degraders and uses thereof | 20200319 |
WO-2021170109-A1 | Tropomyosin receptor kinase (trk) degradation compounds and methods of use | 20200226 |
Complexity: | 192 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 169.01752115 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 169.01752115 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 62.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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