2,3,4,5,6-Pentafluorophenylacetic acid - CAS 653-21-4
Catalog: |
BB032698 |
Product Name: |
2,3,4,5,6-Pentafluorophenylacetic acid |
CAS: |
653-21-4 |
Synonyms: |
2-(2,3,4,5,6-pentafluorophenyl)acetic acid |
IUPAC Name: | 2-(2,3,4,5,6-pentafluorophenyl)acetic acid |
Description: | 2,3,4,5,6-Pentafluorophenylacetic acid (CAS# 653-21-4) is a useful research chemical. |
Molecular Weight: | 226.10 |
Molecular Formula: | C8H3F5O2 |
Canonical SMILES: | C(C1=C(C(=C(C(=C1F)F)F)F)F)C(=O)O |
InChI: | InChI=1S/C8H3F5O2/c9-4-2(1-3(14)15)5(10)7(12)8(13)6(4)11/h1H2,(H,14,15) |
InChI Key: | LGCODSNZJOVMHV-UHFFFAOYSA-N |
Boiling Point: | 235.3 ℃ at 760 mmHg |
Melting Point: | 108-110 ℃ (lit.) |
Purity: | 95 % |
Density: | 1.639 g/cm3 |
Appearance: | White crystalline powder |
MDL: | MFCD00004316 |
LogP: | 2.00920 |
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-2021170886-A2 | Electronic device | 20200806 |
CN-111135810-A | Preparation method of special chromatographic separation medium for cannabidiol separation | 20200122 |
US-2021213172-A1 | Thermosensitive peptide hydrogel | 20200110 |
WO-2021119554-A1 | Compositions and methods for potentiating immune activity | 20191212 |
CN-111868253-A | Method for extracting nucleic acid | 20180316 |
Complexity: | 233 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 226.00532014 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 7 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 226.00532014 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 37.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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