1,1,2,2-Tetrakis(p-hydroxyphenyl)ethane - CAS 7727-33-5
Catalog: |
BB035871 |
Product Name: |
1,1,2,2-Tetrakis(p-hydroxyphenyl)ethane |
CAS: |
7727-33-5 |
Synonyms: |
4-[1,2,2-tris(4-hydroxyphenyl)ethyl]phenol |
IUPAC Name: | 4-[1,2,2-tris(4-hydroxyphenyl)ethyl]phenol |
Description: | 1,1,2,2-Tetrakis(p-hydroxyphenyl)ethane (CAS# 7727-33-5) is a compound useful in organic synthesis. |
Molecular Weight: | 398.45 |
Molecular Formula: | C26H22O4 |
Canonical SMILES: | C1=CC(=CC=C1C(C2=CC=C(C=C2)O)C(C3=CC=C(C=C3)O)C4=CC=C(C=C4)O)O |
InChI: | InChI=1S/C26H22O4/c27-21-9-1-17(2-10-21)25(18-3-11-22(28)12-4-18)26(19-5-13-23(29)14-6-19)20-7-15-24(30)16-8-20/h1-16,25-30H |
InChI Key: | HDPBBNNDDQOWPJ-UHFFFAOYSA-N |
Boiling Point: | 566.4 °C at 760 mmHg |
Melting Point: | >250 °C (dec.) |
Purity: | 95 % |
Density: | 1.309 g/cm3 |
Appearance: | White solid |
Storage: | Refrigerator |
MDL: | MFCD00002371 |
LogP: | 5.47300 |
GHS Hazard Statement: | H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation] |
Precautionary Statement: | P273, P280, P305+P351+P338, P310, P391, and P501 |
Signal Word: | Danger |
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PMID | Publication Date | Title | Journal |
28594102 | 20170901 | The inhibition effects of some natural products on lactoperoxidase purified from bovine milk | Journal of biochemical and molecular toxicology |
21125131 | 20110121 | Synthesis and characterization, novel across adjacent ring formed phthalocyanine | Dalton transactions (Cambridge, England : 2003) |
Complexity: | 403 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 398.15180918 |
Formal Charge: | 0 |
Heavy Atom Count: | 30 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 4 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 398.15180918 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 80.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 5.6 |
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