Methyl 4'-Hydroxybiphenyl-4-carboxylate - CAS 40501-41-5
Catalog: |
BB024535 |
Product Name: |
Methyl 4'-Hydroxybiphenyl-4-carboxylate |
CAS: |
40501-41-5 |
Synonyms: |
4-(4-hydroxyphenyl)benzoic acid methyl ester; methyl 4-(4-hydroxyphenyl)benzoate |
IUPAC Name: | methyl 4-(4-hydroxyphenyl)benzoate |
Description: | Methyl 4'-Hydroxybiphenyl-4-carboxylate (CAS# 40501-41-5) is a useful research chemical. |
Molecular Weight: | 228.24 |
Molecular Formula: | C14H12O3 |
Canonical SMILES: | COC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)O |
InChI: | InChI=1S/C14H12O3/c1-17-14(16)12-4-2-10(3-5-12)11-6-8-13(15)9-7-11/h2-9,15H,1H3 |
InChI Key: | PHBQSOODLMGROT-UHFFFAOYSA-N |
Appearance: | Solid |
LogP: | 2.84580 |
GHS Hazard Statement: | H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard] |
Precautionary Statement: | P273, P391, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2020003938-A1 | Polarizer and image display device | 20180627 |
WO-2020004106-A1 | Polarizer and image display device | 20180627 |
WO-2020004303-A1 | Polarizer and image display device | 20180627 |
CN-112334797-A | Polarizer and image display device | 20180627 |
US-2021109270-A1 | Polarizer and image display device | 20180627 |
PMID | Publication Date | Title | Journal |
16841348 | 20060816 | Exploring and expanding the structural diversity of self-assembling dendrons through combinations of AB, constitutional isomeric AB2, and AB3 biphenyl-4-methyl ether building blocks | Chemistry (Weinheim an der Bergstrasse, Germany) |
12873498 | 20030818 | A specific anti-Helicobacter pylori agent NE2001: synthesis and its effect on the growth of H. pylori | Bioorganic & medicinal chemistry letters |
Complexity: | 248 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 228.078644241 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 228.078644241 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 46.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.6 |
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