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

Technical Data

Patents

Computed Properties

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

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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