2,3-dihydrofuran;ethyl propanoate

C9H16O3 — CID 174845648

IUPAC2,3-dihydrofuran;ethyl propanoate
SMILESC1=COCC1.CCOC(=O)CC
InChIInChI=1S/C5H10O2.C4H6O/c1-3-5(6)7-4-2;1-2-4-5-3-1/h3-4H2,1-2H3;1,3H,2,4H2
InChIKeyYOYMKBULAFRCJT-UHFFFAOYSA-N
MW172.22 g/mol
LogP1.88
Rot. Bonds2

About 2,3-dihydrofuran;ethyl propanoate

2,3-dihydrofuran;ethyl propanoate (PubChem CID 174845648) has the molecular formula C9H16O3 and a molecular weight of 172.22 g/mol. Its IUPAC name is 2,3-dihydrofuran;ethyl propanoate.

Molecular Properties

Compound Name2,3-dihydrofuran;ethyl propanoate
PubChem CID174845648
Molecular FormulaC9H16O3
Molecular Weight172.22 g/mol
Exact Mass172.11
IUPAC Name2,3-dihydrofuran;ethyl propanoate
SMILESC1=COCC1.CCOC(=O)CC
InChIInChI=1S/C5H10O2.C4H6O/c1-3-5(6)7-4-2;1-2-4-5-3-1/h3-4H2,1-2H3;1,3H,2,4H2
InChIKeyYOYMKBULAFRCJT-UHFFFAOYSA-N
XLogP1.88
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.22
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 174819843
ethyl propanoate;methane
CID 161360642
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ethyl propanoate;titanium(4+);tetrachloride
CID 173205872
calcium;ethyl propanoate;hydride
CID 173132885
ethyl propanoate;tin(2+);dichloride
CID 171374953
(2-ethoxy-2-oxoethyl) propanoate
CID 13301802
ethyl propanoate;methanesulfonic acid
CID 159764839
ethyl butanoate;ethyl propanoate
CID 159309203
azane;bicyclo[3.1.1]hepta-1(6),2,4-triene;ethyl propanoate
CID 175267221
bicyclo[3.1.0]hexa-1(6),2,4-triene;ethyl propanoate
CID 68972161
butan-1-ol;ethyl propanoate
CID 157384460

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydrofuran;ethyl propanoate?
The IUPAC name of 2,3-dihydrofuran;ethyl propanoate (CID 174845648) is 2,3-dihydrofuran;ethyl propanoate.
What is the SMILES notation for 2,3-dihydrofuran;ethyl propanoate?
The canonical SMILES for 2,3-dihydrofuran;ethyl propanoate is C1=COCC1.CCOC(=O)CC.
What is the InChIKey of 2,3-dihydrofuran;ethyl propanoate?
The InChIKey is YOYMKBULAFRCJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10O2.C4H6O/c1-3-5(6)7-4-2;1-2-4-5-3-1/h3-4H2,1-2H3;1,3H,2,4H2.
What are the key properties of 2,3-dihydrofuran;ethyl propanoate?
2,3-dihydrofuran;ethyl propanoate has a molecular weight of 172.22 g/mol, XLogP of 1.88, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydrofuran;ethyl propanoate is sourced from PubChem (CID 174845648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).