Isoindoline-2-ethanol - CAS 57944-79-3
Catalog: |
BB029869 |
Product Name: |
Isoindoline-2-ethanol |
CAS: |
57944-79-3 |
Synonyms: |
2-(1,3-dihydroisoindol-2-yl)ethanol; 2-(1,3-dihydroisoindol-2-yl)ethanol |
IUPAC Name: | 2-(1,3-dihydroisoindol-2-yl)ethanol |
Description: | Isoindoline-2-ethanol (CAS# 57944-79-3 ) is a useful research chemical. |
Molecular Weight: | 163.22 |
Molecular Formula: | C10H13NO |
Canonical SMILES: | C1C2=CC=CC=C2CN1CCO |
InChI: | InChI=1S/C10H13NO/c12-6-5-11-7-9-3-1-2-4-10(9)8-11/h1-4,12H,5-8H2 |
InChI Key: | RPYLGKKUWYIZNY-UHFFFAOYSA-N |
Boiling Point: | 275.797 °C at 760 mmHg |
Density: | 1.128 g/cm3 |
LogP: | 0.93240 |
Publication Number | Title | Priority Date |
JP-2021509401-A | Glucolic acid oxidase inhibitor for the treatment of disease | 20171229 |
TW-201908305-A | COT regulator and method of use thereof | 20150706 |
WO-2014152494-A1 | Prodrugs of fumarates and their use in treating various deseases | 20130314 |
EP-2935247-B1 | Prmt5 inhibitors and uses thereof | 20121221 |
US-2013281399-A1 | Treatment of diseases by epigenetic regulation | 20120419 |
Complexity: | 135 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 163.099714038 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 163.099714038 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 23.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.6 |
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