ethyl 2-[2-(oxolan-2-yl)phenoxy]acetate

C14H18O4 — CID 118270818

IUPACethyl 2-[2-(oxolan-2-yl)phenoxy]acetate
SMILESCCOC(=O)COc1ccccc1C1CCCO1
InChIInChI=1S/C14H18O4/c1-2-16-14(15)10-18-13-7-4-3-6-11(13)12-8-5-9-17-12/h3-4,6-7,12H,2,5,8-10H2,1H3
InChIKeyQNOSUSDFQBXADR-UHFFFAOYSA-N
MW250.29 g/mol
LogP2.48
Rot. Bonds5

About ethyl 2-[2-(oxolan-2-yl)phenoxy]acetate

ethyl 2-[2-(oxolan-2-yl)phenoxy]acetate (PubChem CID 118270818) has the molecular formula C14H18O4 and a molecular weight of 250.29 g/mol. Its IUPAC name is ethyl 2-[2-(oxolan-2-yl)phenoxy]acetate.

Molecular Properties

Compound Nameethyl 2-[2-(oxolan-2-yl)phenoxy]acetate
PubChem CID118270818
Molecular FormulaC14H18O4
Molecular Weight250.29 g/mol
Exact Mass250.12
IUPAC Nameethyl 2-[2-(oxolan-2-yl)phenoxy]acetate
SMILESCCOC(=O)COc1ccccc1C1CCCO1
InChIInChI=1S/C14H18O4/c1-2-16-14(15)10-18-13-7-4-3-6-11(13)12-8-5-9-17-12/h3-4,6-7,12H,2,5,8-10H2,1H3
InChIKeyQNOSUSDFQBXADR-UHFFFAOYSA-N
XLogP2.48
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.29
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2-[2-(1,3-dioxan-2-yl)phenoxy]acetate
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(2-ethoxy-2-oxoethyl) 2-(2-methylphenoxy)acetate
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2-(2-ethoxy-2-oxoethoxy)benzoic acid
CID 1302464
ethyl 2-[2-(oxolan-2-yl)benzimidazol-1-yl]acetate
CID 17000123
ethyl 2-[(6-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)oxy]acetate
CID 67613778
ethyl 2-[2-[(4S)-5-[(2-methoxyphenyl)carbamoyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-4-yl]phenoxy]acetate
CID 1302656
[2-(oxan-2-yl)phenyl] methanesulfonate
CID 166653039
3-(oxolan-2-yl)propyl 2-(2-aminophenoxy)acetate
CID 65166038
ethyl 2-(4-chloro-2-cycloheptylphenoxy)acetate
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ethyl 2-[2-[(1S)-1-hydroxyethyl]phenoxy]acetate
CID 78931582
ethyl 2-[(3-cyclopentyl-1H-indol-4-yl)oxy]acetate
CID 71736777

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[2-(oxolan-2-yl)phenoxy]acetate?
The IUPAC name of ethyl 2-[2-(oxolan-2-yl)phenoxy]acetate (CID 118270818) is ethyl 2-[2-(oxolan-2-yl)phenoxy]acetate.
What is the SMILES notation for ethyl 2-[2-(oxolan-2-yl)phenoxy]acetate?
The canonical SMILES for ethyl 2-[2-(oxolan-2-yl)phenoxy]acetate is CCOC(=O)COc1ccccc1C1CCCO1.
What is the InChIKey of ethyl 2-[2-(oxolan-2-yl)phenoxy]acetate?
The InChIKey is QNOSUSDFQBXADR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18O4/c1-2-16-14(15)10-18-13-7-4-3-6-11(13)12-8-5-9-17-12/h3-4,6-7,12H,2,5,8-10H2,1H3.
What are the key properties of ethyl 2-[2-(oxolan-2-yl)phenoxy]acetate?
ethyl 2-[2-(oxolan-2-yl)phenoxy]acetate has a molecular weight of 250.29 g/mol, XLogP of 2.48, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[2-(oxolan-2-yl)phenoxy]acetate is sourced from PubChem (CID 118270818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).