3-(4-Methoxyphenoxy)propionic Acid - CAS 20811-60-3
Catalog: |
BB016321 |
Product Name: |
3-(4-Methoxyphenoxy)propionic Acid |
CAS: |
20811-60-3 |
Synonyms: |
3-(4-methoxyphenoxy)propanoic acid; 3-(4-methoxyphenoxy)propanoic acid |
IUPAC Name: | 3-(4-methoxyphenoxy)propanoic acid |
Description: | 3-(4-Methoxyphenoxy)propionic Acid (CAS# 20811-60-3) is a useful research chemical. |
Molecular Weight: | 196.20 |
Molecular Formula: | C10H12O4 |
Canonical SMILES: | COC1=CC=C(C=C1)OCCC(=O)O |
InChI: | InChI=1S/C10H12O4/c1-13-8-2-4-9(5-3-8)14-7-6-10(11)12/h2-5H,6-7H2,1H3,(H,11,12) |
InChI Key: | SGTCAUQLJIKBMM-UHFFFAOYSA-N |
Boiling Point: | 321.7 ℃ at 760 mmHg |
Density: | 1.188 g/cm3 |
LogP: | 1.54870 |
GHS Hazard Statement: | H302 (97.44%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P312, P330, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2020138766-A1 | Ccl5 inhibitors | 20180615 |
US-10940132-B2 | CCL5 inhibitors | 20180615 |
US-2021196665-A1 | CCL5 Inhibitors | 20180615 |
CA-3064078-A1 | Ccl2 inhibitors | 20170613 |
US-2020181062-A1 | Ccl2 inhibitors | 20170613 |
Complexity: | 173 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 196.07355886 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 196.07355886 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 55.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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