2-(2-ethyloxolan-2-yl)acetic acid

C8H14O3 — CID 18432801

IUPAC2-(2-ethyloxolan-2-yl)acetic acid
SMILESCCC1(CC(=O)O)CCCO1
InChIInChI=1S/C8H14O3/c1-2-8(6-7(9)10)4-3-5-11-8/h2-6H2,1H3,(H,9,10)
InChIKeyFWQFVNWXZCJFAN-UHFFFAOYSA-N
MW158.20 g/mol
LogP1.42
Rot. Bonds3

About 2-(2-ethyloxolan-2-yl)acetic acid

2-(2-ethyloxolan-2-yl)acetic acid (PubChem CID 18432801) has the molecular formula C8H14O3 and a molecular weight of 158.20 g/mol. Its IUPAC name is 2-(2-ethyloxolan-2-yl)acetic acid.

Molecular Properties

Compound Name2-(2-ethyloxolan-2-yl)acetic acid
PubChem CID18432801
Molecular FormulaC8H14O3
Molecular Weight158.20 g/mol
Exact Mass158.09
IUPAC Name2-(2-ethyloxolan-2-yl)acetic acid
SMILESCCC1(CC(=O)O)CCCO1
InChIInChI=1S/C8H14O3/c1-2-8(6-7(9)10)4-3-5-11-8/h2-6H2,1H3,(H,9,10)
InChIKeyFWQFVNWXZCJFAN-UHFFFAOYSA-N
XLogP1.42
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-(2-hydroxyethyl)oxolan-2-yl]acetic acid
CID 57203496
CID 71376373
CID 71376373
2-(2-ethyloxolan-2-yl)ethanol
CID 142632895
1-[(2R)-2-ethyloxolan-2-yl]ethanone
CID 167251842
2-(2-ethyl-1,3-dioxolan-2-yl)acetic acid
CID 13085716
2-butyl-2-ethyloxolane;methane
CID 159867268
2-(5-ethyl-3-methyl-4H-1,2-oxazol-5-yl)acetic acid
CID 134338083
(2-propyloxan-2-yl)methanol
CID 130609944
2-ethyl-2-(2-methylprop-1-enoxymethyl)oxane
CID 176604881
[2-[(1-methylcyclopentyl)methyl]oxolan-2-yl]methanol
CID 130609963
acetic acid;2,2-diethylmorpholine
CID 70348686
2-(3-ethoxyoxan-3-yl)acetic acid
CID 105443019

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethyloxolan-2-yl)acetic acid?
The IUPAC name of 2-(2-ethyloxolan-2-yl)acetic acid (CID 18432801) is 2-(2-ethyloxolan-2-yl)acetic acid.
What is the SMILES notation for 2-(2-ethyloxolan-2-yl)acetic acid?
The canonical SMILES for 2-(2-ethyloxolan-2-yl)acetic acid is CCC1(CC(=O)O)CCCO1.
What is the InChIKey of 2-(2-ethyloxolan-2-yl)acetic acid?
The InChIKey is FWQFVNWXZCJFAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O3/c1-2-8(6-7(9)10)4-3-5-11-8/h2-6H2,1H3,(H,9,10).
What are the key properties of 2-(2-ethyloxolan-2-yl)acetic acid?
2-(2-ethyloxolan-2-yl)acetic acid has a molecular weight of 158.20 g/mol, XLogP of 1.42, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethyloxolan-2-yl)acetic acid is sourced from PubChem (CID 18432801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).