Ethyl 2-Hydroxycyclopentanecarboxylate - CAS 54972-10-0
Catalog: |
BB028874 |
Product Name: |
Ethyl 2-Hydroxycyclopentanecarboxylate |
CAS: |
54972-10-0 |
Synonyms: |
2-hydroxy-1-cyclopentanecarboxylic acid ethyl ester; ethyl 2-hydroxycyclopentane-1-carboxylate |
IUPAC Name: | ethyl 2-hydroxycyclopentane-1-carboxylate |
Description: | Ethyl 2-Hydroxycyclopentanecarboxylate (CAS# 54972-10-0) is a useful research chemical. |
Molecular Weight: | 158.19 |
Molecular Formula: | C8H14O3 |
Canonical SMILES: | CCOC(=O)C1CCCC1O |
InChI: | InChI=1S/C8H14O3/c1-2-11-8(10)6-4-3-5-7(6)9/h6-7,9H,2-5H2,1H3 |
InChI Key: | IIFIGGNBUOZGAB-UHFFFAOYSA-N |
MDL: | MFCD02093827 |
LogP: | 0.71050 |
Publication Number | Title | Priority Date |
EP-3341353-A1 | Therapeutic compounds and methods of use thereof | 20150827 |
JP-2018526371-A | Therapeutic compounds and methods of use thereof | 20150827 |
US-2018230079-A1 | Therapeutic compounds and methods of use thereof | 20150827 |
US-2020087239-A1 | Therapeutic compounds and methods of use thereof | 20150827 |
WO-2017035271-A1 | Therapeutic compounds and methods of use thereof | 20150827 |
Complexity: | 144 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 158.094294304 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 158.094294304 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 46.5 |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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