2-(3-Fluorophenoxy)propanoic Acid - CAS 91054-27-2
Catalog: |
BB040031 |
Product Name: |
2-(3-Fluorophenoxy)propanoic Acid |
CAS: |
91054-27-2 |
Synonyms: |
2-(3-fluorophenoxy)propanoic acid; 2-(3-fluorophenoxy)propanoic acid |
IUPAC Name: | 2-(3-fluorophenoxy)propanoic acid |
Description: | 2-(3-Fluorophenoxy)propanoic Acid (CAS# 91054-27-2) is a useful research chemical. |
Molecular Weight: | 184.16 |
Molecular Formula: | C9H9FO3 |
Canonical SMILES: | CC(C(=O)O)OC1=CC(=CC=C1)F |
InChI: | InChI=1S/C9H9FO3/c1-6(9(11)12)13-8-4-2-3-7(10)5-8/h2-6H,1H3,(H,11,12) |
InChI Key: | HHNWBAYKSQUOFN-UHFFFAOYSA-N |
LogP: | 1.67760 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
EP-2300477-A1 | Tricyclic nitrogen containing compounds and their use as antibacterials | 20080523 |
US-2011071155-A1 | Tricyclic Nitrogen Containing Compounds And Their Use As Antibacterials | 20080523 |
US-2010137353-A1 | Tricyclic compounds as antibacterials | 20070420 |
KR-20060060007-A | 2- (quinoxaline-5-ylsulfonylamino) -benzamide compound as a CC2 modulator | 20030808 |
US-5928912-A | Process for the hydroxylation of aromatic acids using strains of the fungus Beauveria | 19911224 |
Complexity: | 184 |
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: | 3 |
Topological Polar Surface Area: | 46.5 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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