4-Hydroxy-2-(trifluoromethyl)benzoic acid - CAS 320-32-1
Catalog: |
BB021131 |
Product Name: |
4-Hydroxy-2-(trifluoromethyl)benzoic acid |
CAS: |
320-32-1 |
Synonyms: |
4-hydroxy-2-(trifluoromethyl)benzoic acid; 4-hydroxy-2-(trifluoromethyl)benzoic acid |
IUPAC Name: | 4-hydroxy-2-(trifluoromethyl)benzoic acid |
Description: | 4-Hydroxy-2-(trifluoromethyl)benzoic acid (CAS# 320-32-1) is a useful research chemical. |
Molecular Weight: | 206.12 |
Molecular Formula: | C8H5F3O3 |
Canonical SMILES: | C1=CC(=C(C=C1O)C(F)(F)F)C(=O)O |
InChI: | InChI=1S/C8H5F3O3/c9-8(10,11)6-3-4(12)1-2-5(6)7(13)14/h1-3,12H,(H,13,14) |
InChI Key: | CSQAVQLFCBRQJM-UHFFFAOYSA-N |
Boiling Point: | 322.6 °C at 760 mmHg |
Melting Point: | 159-161 °C |
Purity: | 95 % |
Density: | 1.539 g/cm3 |
MDL: | MFCD01091007 |
LogP: | 2.10920 |
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-2021194321-A1 | Benzimidazole thiophene derivative compounds inducing selective degradation of plk1 | 20200327 |
CN-113365995-A | Immunomodulator, composition and method thereof | 20190131 |
TW-202023535-A | DP antagonist | 20180920 |
EP-3854781-A1 | Dp antagonist | 20180920 |
KR-20210065944-A | DP antagonist | 20180920 |
Complexity: | 226 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 206.01907850 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 206.01907850 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 57.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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