5-Fluoro-2-(trifluoromethyl)benzoic acid - CAS 654-99-9
Catalog: |
BB032746 |
Product Name: |
5-Fluoro-2-(trifluoromethyl)benzoic acid |
CAS: |
654-99-9 |
Synonyms: |
5-fluoro-2-(trifluoromethyl)benzoic acid |
IUPAC Name: | 5-fluoro-2-(trifluoromethyl)benzoic acid |
Description: | 5-Fluoro-2-(trifluoromethyl)benzoic acid (CAS# 654-99-9) is a useful research chemical. |
Molecular Weight: | 208.11 |
Molecular Formula: | C8H4F4O2 |
Canonical SMILES: | C1=CC(=C(C=C1F)C(=O)O)C(F)(F)F |
InChI: | InChI=1S/C8H4F4O2/c9-4-1-2-6(8(10,11)12)5(3-4)7(13)14/h1-3H,(H,13,14) |
InChI Key: | BRFNBGWEOKQIND-UHFFFAOYSA-N |
Boiling Point: | 238.2 °C at 760 mmHg |
Purity: | 98 % |
Density: | 1.489 g/cm3 |
Appearance: | White to light yellow crystal powder |
MDL: | MFCD00083521 |
LogP: | 2.54270 |
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-2021083949-A1 | Bifunctional compounds for the treatment of cancer | 20191029 |
WO-2020231739-A2 | Compounds and methods for treating cancer | 20190510 |
JP-2020109086-A | Pharmaceutical composition | 20181228 |
JP-2021102653-A | Pharmaceutical composition | 20181228 |
JP-6868089-B2 | Medicine | 20181228 |
Complexity: | 226 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 208.01474201 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 208.01474201 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 37.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
-
Catalog: BB038165
(2-Chloro-5-fluoro-pyridin-3-yl)-methanol
Detail
-
Catalog: BB030493
(2,6-Difluorophenyl)thiourea
Detail
-
Catalog: BB029630
(2,3-Difluorophenyl)thiourea
Detail
-
Catalog: BB038186
(2,2,3,3-Tetrafluoropropoxy)acetic acid
Detail
-
Catalog: BB022772
(2,8-Bis-trifluoromethyl-quinolin-4-yl)-pyridin-2-yl-methanone
Detail
-
Catalog: BB033560
(2,8-Bis-trifluoromethyl-quinolin-4-yl)-pyridin-2-yl-methanol
Detail
-
Catalog: BB020733
(1S,4S)-(-)-2-(4-Fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane hydrobromide
Detail
-
Catalog: BB007044
(1,10-Phenanthroline)(trifluoromethyl)copper(I)
Detail
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Fluorinated Building Blocks
-
[1427357-61-6]C6H4FN3
6-Fluoro-[1,2,4]triazolo[1,5-a]pyridine
-
[1820736-42-2]C11H11ClF3N3
1-{4-[3-(Trifluoromethyl)-1H-pyrazol-1-yl]phenyl}methanamine hydrochloride
-
[1018125-51-3]C12H12F3N3O2
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid
-
[1170836-29-9]C12H12F3N5
3-(1',3'-Dimethyl-5-(trifluoromethyl)-1'H,2H-[3,4'-bipyrazol]-2-yl)propanenitrile
-
[1795420-51-7]C6H6F3N3O2
3-Amino-1-(2,2,2-trifluoroethyl)pyrazole-4-carboxylic acid
-
[1211518-11-4]C4H2ClF3N4
4-chloro-6-(trifluoromethyl)-1,3,5-triazin-2-amine
Other Pyrimidines
Customers Also Viewed
-
[1071224-34-4]
7-Bromo-2,1,3-benzothiadiazole-4-carboxaldehyde
-
[1211537-07-3]
6-Chloro-3-methylpicolinaldehyde
-
[711-38-6]
2,2,2-Trifluoro-4'-methoxyacetophenone
-
[90852-19-0]
Bis(N-diazo)-tris(O-acetyl)-2-deoxystreptamine
-
[63089-56-5]
4-Amino-1,2,3,5,6,7-hexahydro-s-indacene
-
[80935-59-7]
(Benzene-1,3,5-triyl)triacetonitrile
INDUSTRY LEADERS TRUST OUR PRODUCTS