6-phenoxynicotinic acid - CAS 51362-38-0
Catalog: |
BB027418 |
Product Name: |
6-phenoxynicotinic acid |
CAS: |
51362-38-0 |
Synonyms: |
6-phenoxy-3-pyridinecarboxylic acid; 6-phenoxypyridine-3-carboxylic acid |
IUPAC Name: | 6-phenoxypyridine-3-carboxylic acid |
Description: | 6-phenoxynicotinic acid (CAS# 51362-38-0) is a useful research chemical. |
Molecular Weight: | 215.20 |
Molecular Formula: | C12H9NO3 |
Canonical SMILES: | C1=CC=C(C=C1)OC2=NC=C(C=C2)C(=O)O |
InChI: | InChI=1S/C12H9NO3/c14-12(15)9-6-7-11(13-8-9)16-10-4-2-1-3-5-10/h1-8H,(H,14,15) |
InChI Key: | GFEUNYLQJDQNAN-UHFFFAOYSA-N |
Boiling Point: | 391.2 °C at 760 mmHg |
Density: | 1.298 g/cm3 |
Appearance: | White solid |
MDL: | MFCD02682068 |
LogP: | 2.57210 |
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 |
AU-2018321845-A1 | Metabolically stable N-acylaminooxadiazoles useful as antibacterial agents | 20170821 |
CA-3072103-A1 | Metabolically stable n-acylaminooxadiazoles useful as antibacterial agents | 20170821 |
EP-3672946-A1 | Metabolically stable n-acylaminooxadiazoles useful as antibacterial agents | 20170821 |
KR-20200049797-A | Metabolic stable N-acylaminooxadiazole useful as an antibacterial agent | 20170821 |
WO-2019040404-A1 | METABOLIC-STABLE METABOLIC-N-ACYLAMINOOXADIAZOLES USEFUL AS ANTIBACTERIAL AGENTS | 20170821 |
Complexity: | 238 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 215.058243149 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 215.058243149 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 59.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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