(R)-1,1,2-Triphenyl-1,2-ethanediol - CAS 95061-46-4
Catalog: |
BB041603 |
Product Name: |
(R)-1,1,2-Triphenyl-1,2-ethanediol |
CAS: |
95061-46-4 |
Synonyms: |
(2R)-1,1,2-triphenylethane-1,2-diol; (2R)-1,1,2-triphenylethane-1,2-diol |
IUPAC Name: | (2R)-1,1,2-triphenylethane-1,2-diol |
Description: | (R)-1,1,2-Triphenyl-1,2-ethanediol (CAS# 95061-46-4) is a useful research chemical compound. |
Molecular Weight: | 290.36 |
Molecular Formula: | C20H18O2 |
Canonical SMILES: | C1=CC=C(C=C1)C(C(C2=CC=CC=C2)(C3=CC=CC=C3)O)O |
InChI: | InChI=1S/C20H18O2/c21-19(16-10-4-1-5-11-16)20(22,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15,19,21-22H/t19-/m1/s1 |
InChI Key: | GWVWUZJOQHWMFB-LJQANCHMSA-N |
Boiling Point: | 452.3 °C at 760 mmHg |
Density: | 1.196 g/cm3 |
Storage: | Sealed in dry, Room Temperature |
MDL: | MFCD00134424 |
LogP: | 3.65610 |
Publication Number | Title | Priority Date |
CN-109195954-A | The chiral resolution and its eutectic of the intermediate of Wo Leisheng | 20160606 |
EP-3464250-A1 | Chiral resolution of an intermediate of suvorexant and cocrystals thereof | 20160606 |
JP-2019517585-A | Chiral resolution of suvorexant intermediate and its co-crystal | 20160606 |
US-2019276414-A1 | Chiral resolution of an intermediate of suvorexant and cocrystals thereof | 20160606 |
WO-2017211733-A1 | Chiral resolution of an intermediate of suvorexant and cocrystals thereof | 20160606 |
Complexity: | 305 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 290.130679813 |
Formal Charge: | 0 |
Heavy Atom Count: | 22 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 290.130679813 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 40.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.4 |
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