4-Fluoro-3-(trifluoromethyl)benzaldehyde - CAS 67515-60-0
Catalog: |
BB033309 |
Product Name: |
4-Fluoro-3-(trifluoromethyl)benzaldehyde |
CAS: |
67515-60-0 |
Synonyms: |
4-fluoro-3-(trifluoromethyl)benzaldehyde |
IUPAC Name: | 4-fluoro-3-(trifluoromethyl)benzaldehyde |
Description: | 4-Fluoro-3-(trifluoromethyl)benzaldehyde (CAS# 67515-60-0) is a useful research chemical. |
Molecular Weight: | 192.11 |
Molecular Formula: | C8H4F4O |
Canonical SMILES: | C1=CC(=C(C=C1C=O)C(F)(F)F)F |
InChI: | InChI=1S/C8H4F4O/c9-7-2-1-5(4-13)3-6(7)8(10,11)12/h1-4H |
InChI Key: | BIUDHHGROGJSHN-UHFFFAOYSA-N |
Boiling Point: | 178 °C |
Melting Point: | 114.0-116.0 °C |
Purity: | 96 % |
Density: | 1.408 g/cm3 |
MDL: | MFCD00061314 |
LogP: | 2.65700 |
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-2021203016-A2 | Protein-protein interaction stabilizers | 20200403 |
US-2021317123-A1 | Cbp/catenin signaling pathway inhibitors and uses thereof | 20200312 |
WO-2021147971-A1 | Compound for treating alzheimer's disease | 20200121 |
US-2021047294-A1 | Imidazolyl pyrimidinylamine compounds as cdk2 inhibitors | 20190814 |
WO-2021030537-A1 | Imidazolyl pyrimidinylamine compounds as cdk2 inhibitors | 20190814 |
Complexity: | 189 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 192.01982740 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 192.01982740 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 17.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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