3-(2-Fluorophenoxy)propionic Acid - CAS 2967-72-8
Catalog: |
BB020268 |
Product Name: |
3-(2-Fluorophenoxy)propionic Acid |
CAS: |
2967-72-8 |
Synonyms: |
3-(2-fluorophenoxy)propanoic acid; 3-(2-fluorophenoxy)propanoic acid |
IUPAC Name: | 3-(2-fluorophenoxy)propanoic acid |
Description: | 3-(2-Fluorophenoxy)propionic Acid (CAS# 2967-72-8 ) is a useful research chemical. |
Molecular Weight: | 184.16 |
Molecular Formula: | C9H9FO3 |
Canonical SMILES: | C1=CC=C(C(=C1)OCCC(=O)O)F |
InChI: | InChI=1S/C9H9FO3/c10-7-3-1-2-4-8(7)13-6-5-9(11)12/h1-4H,5-6H2,(H,11,12) |
InChI Key: | HTFQCXHHEIUZPM-UHFFFAOYSA-N |
Boiling Point: | 282.5 °C at 760 mmHg |
Density: | 1.267 g/cm3 |
LogP: | 1.67920 |
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 |
EP-2913330-A1 | Condensed derivatives of imidazole useful as pharmaceuticals | 20140227 |
EP-3110803-A1 | Heteroaromatic derivatives and their use as pharmaceuticals | 20140227 |
EP-3110803-B1 | Heteroaromatic derivatives and their use as pharmaceuticals | 20140227 |
JP-2017510564-A | Novel heteroaromatic derivatives and their use as pharmaceuticals | 20140227 |
US-10301305-B2 | Heteroaromatic derivatives and their use as pharmaceuticals | 20140227 |
PMID | Publication Date | Title | Journal |
21522632 | 20101215 | 3-(2-Fluoro-phen-oxy)propanoic acid | Acta crystallographica. Section E, Structure reports online |
Complexity: | 172 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 184.05357231 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 184.05357231 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 46.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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