2-ethoxy-3-(furan-2-ylmethoxy)propanoic acid

C10H14O5 — CID 63074632

IUPAC2-ethoxy-3-(furan-2-ylmethoxy)propanoic acid
SMILESCCOC(COCc1ccco1)C(=O)O
InChIInChI=1S/C10H14O5/c1-2-14-9(10(11)12)7-13-6-8-4-3-5-15-8/h3-5,9H,2,6-7H2,1H3,(H,11,12)
InChIKeyKAZLRHWUCPSCLE-UHFFFAOYSA-N
MW214.22 g/mol
LogP1.29
Rot. Bonds7

About 2-ethoxy-3-(furan-2-ylmethoxy)propanoic acid

2-ethoxy-3-(furan-2-ylmethoxy)propanoic acid (PubChem CID 63074632) has the molecular formula C10H14O5 and a molecular weight of 214.22 g/mol. Its IUPAC name is 2-ethoxy-3-(furan-2-ylmethoxy)propanoic acid.

Molecular Properties

Compound Name2-ethoxy-3-(furan-2-ylmethoxy)propanoic acid
PubChem CID63074632
Molecular FormulaC10H14O5
Molecular Weight214.22 g/mol
Exact Mass214.08
IUPAC Name2-ethoxy-3-(furan-2-ylmethoxy)propanoic acid
SMILESCCOC(COCc1ccco1)C(=O)O
InChIInChI=1S/C10H14O5/c1-2-14-9(10(11)12)7-13-6-8-4-3-5-15-8/h3-5,9H,2,6-7H2,1H3,(H,11,12)
InChIKeyKAZLRHWUCPSCLE-UHFFFAOYSA-N
XLogP1.29
TPSA68.90 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.22
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-3-(furan-2-ylmethoxy)propanoic acid
CID 65443764
ethyl 2-(furan-2-ylmethoxy)pentanoate
CID 83038819
2-fluoro-2-(furan-2-ylmethoxy)acetic acid
CID 79357493
4-[cyclopropyl(furan-2-ylmethyl)amino]-2-ethoxybutanoic acid
CID 63074910
3-(furan-2-ylmethoxy)-2-methylpropanenitrile
CID 43367411
butane;ethane;2-(ethoxymethyl)furan
CID 143895142
2-ethoxy-3-phenoxypropanoic acid
CID 63074298
3-(furan-2-ylmethoxy)propanoic acid
CID 24710839
3-ethoxy-1-(furan-2-yl)butan-2-one
CID 83171550
2-(ethylperoxymethyl)furan
CID 175094388
1-(furan-2-ylmethoxy)-3-(methylamino)propan-2-ol
CID 2771927
N-tert-butyl-2-[ethyl-[3-(furan-2-ylmethoxy)-2-hydroxypropyl]amino]acetamide
CID 4830564

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-3-(furan-2-ylmethoxy)propanoic acid?
The IUPAC name of 2-ethoxy-3-(furan-2-ylmethoxy)propanoic acid (CID 63074632) is 2-ethoxy-3-(furan-2-ylmethoxy)propanoic acid.
What is the SMILES notation for 2-ethoxy-3-(furan-2-ylmethoxy)propanoic acid?
The canonical SMILES for 2-ethoxy-3-(furan-2-ylmethoxy)propanoic acid is CCOC(COCc1ccco1)C(=O)O.
What is the InChIKey of 2-ethoxy-3-(furan-2-ylmethoxy)propanoic acid?
The InChIKey is KAZLRHWUCPSCLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O5/c1-2-14-9(10(11)12)7-13-6-8-4-3-5-15-8/h3-5,9H,2,6-7H2,1H3,(H,11,12).
What are the key properties of 2-ethoxy-3-(furan-2-ylmethoxy)propanoic acid?
2-ethoxy-3-(furan-2-ylmethoxy)propanoic acid has a molecular weight of 214.22 g/mol, XLogP of 1.29, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-3-(furan-2-ylmethoxy)propanoic acid is sourced from PubChem (CID 63074632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).