5-Chloro-2-fluorophenylacetic Acid - CAS 261762-97-4
Catalog: |
BB019171 |
Product Name: |
5-Chloro-2-fluorophenylacetic Acid |
CAS: |
261762-97-4 |
Synonyms: |
2-(5-chloro-2-fluorophenyl)acetic acid; 2-(5-chloro-2-fluorophenyl)acetic acid |
IUPAC Name: | 2-(5-chloro-2-fluorophenyl)acetic acid |
Description: | 5-Chloro-2-fluorophenylacetic Acid (CAS# 261762-97-4) is a useful research chemical. |
Molecular Weight: | 188.58 |
Molecular Formula: | C8H6ClFO2 |
Canonical SMILES: | C1=CC(=C(C=C1Cl)CC(=O)O)F |
InChI: | InChI=1S/C8H6ClFO2/c9-6-1-2-7(10)5(3-6)4-8(11)12/h1-3H,4H2,(H,11,12) |
InChI Key: | NOKLOLLCDCEFAK-UHFFFAOYSA-N |
Appearance: | White crystalline |
MDL: | MFCD01631439 |
LogP: | 2.10620 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021170886-A2 | Electronic device | 20200806 |
WO-2020229968-A1 | Non-lysosomal glucosylceramidase inhibitors and uses thereof | 20190510 |
AU-2017260125-A1 | Aromatic sulfonamide derivatives | 20160503 |
AU-2017260125-A9 | Aromatic sulfonamide derivatives | 20160503 |
EP-3458443-A1 | Aromatic sulfonamide derivatives | 20160503 |
Complexity: | 174 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 188.0040353 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 188.0040353 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 37.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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