2-[5-(2-hydroxyethyl)furan-2-yl]acetaldehyde

C8H10O3 — CID 153490794

IUPAC2-[5-(2-hydroxyethyl)furan-2-yl]acetaldehyde
SMILESO=CCc1ccc(CCO)o1
InChIInChI=1S/C8H10O3/c9-5-3-7-1-2-8(11-7)4-6-10/h1-2,5,10H,3-4,6H2
InChIKeyHZDHIONPECPGJL-UHFFFAOYSA-N
MW154.16 g/mol
LogP0.56
Rot. Bonds4

About 2-[5-(2-hydroxyethyl)furan-2-yl]acetaldehyde

2-[5-(2-hydroxyethyl)furan-2-yl]acetaldehyde (PubChem CID 153490794) has the molecular formula C8H10O3 and a molecular weight of 154.16 g/mol. Its IUPAC name is 2-[5-(2-hydroxyethyl)furan-2-yl]acetaldehyde.

Molecular Properties

Compound Name2-[5-(2-hydroxyethyl)furan-2-yl]acetaldehyde
PubChem CID153490794
Molecular FormulaC8H10O3
Molecular Weight154.16 g/mol
Exact Mass154.06
IUPAC Name2-[5-(2-hydroxyethyl)furan-2-yl]acetaldehyde
SMILESO=CCc1ccc(CCO)o1
InChIInChI=1S/C8H10O3/c9-5-3-7-1-2-8(11-7)4-6-10/h1-2,5,10H,3-4,6H2
InChIKeyHZDHIONPECPGJL-UHFFFAOYSA-N
XLogP0.56
TPSA50.44 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.16
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

5-(4-hydroxybutyl)furan-2-carbaldehyde;2-[5-(4-hydroxybutyl)furan-2-yl]acetaldehyde;4-[5-(4-hydroxybutyl)furan-2-yl]butanal;5-(2-hydroxyethyl)furan-2-carbaldehyde;2-[5-(2-hydroxyethyl)furan-2-yl]acetaldehyde;5-(6-hydroxyhexyl)furan-2-carbaldehyde;2-[5-(6-hydroxyhexyl)furan-2-yl]acetaldehyde;6-[5-(6-hydroxyhexyl)furan-2-yl]hexanal;5-(hydroxymethyl)furan-2-carbaldehyde;5-(5-hydroxypentyl)furan-2-carbaldehyde;2-[5-(5-hydroxypentyl)furan-2-yl]acetaldehyde;5-[5-(5-hydroxypentyl)furan-2-yl]pentanal;5-(3-hydroxypropyl)furan-2-carbaldehyde;2-[5-(3-hydroxypropyl)furan-2-yl]acetaldehyde;3-[5-(3-hydroxypropyl)furan-2-yl]propanal
CID 159876098
2-(5-chlorofuran-2-yl)acetaldehyde
CID 83826300
ethane;2-(5-methylfuran-2-yl)ethanol
CID 142104864
2-(5-phenylfuran-2-yl)acetaldehyde
CID 101495909
8-[5-(8-hydroxyoctyl)furan-2-yl]octan-1-ol
CID 102476471
3-[5-(3-chloro-3-oxopropyl)furan-2-yl]propanoyl chloride
CID 101056129
5-[5-(2-hydroxyethyl)furan-2-yl]thiolane-3-carboxylic acid
CID 158035626
acetic acid;8-(5-hexylfuran-2-yl)octan-1-ol
CID 71319263
2,5-bis(but-3-enyl)furan
CID 10856026
2-[[5-[2-[5-(2-oxoethyliminomethyl)furan-2-yl]ethyl]furan-2-yl]methylideneamino]acetaldehyde
CID 91153864
5-(2-hydroxyethyl)-3H-1,3-oxazol-2-one
CID 151879178
(5-ethylfuran-2-yl)methanol;prop-2-enal
CID 175292814

Frequently Asked Questions

What is the IUPAC name of 2-[5-(2-hydroxyethyl)furan-2-yl]acetaldehyde?
The IUPAC name of 2-[5-(2-hydroxyethyl)furan-2-yl]acetaldehyde (CID 153490794) is 2-[5-(2-hydroxyethyl)furan-2-yl]acetaldehyde.
What is the SMILES notation for 2-[5-(2-hydroxyethyl)furan-2-yl]acetaldehyde?
The canonical SMILES for 2-[5-(2-hydroxyethyl)furan-2-yl]acetaldehyde is O=CCc1ccc(CCO)o1.
What is the InChIKey of 2-[5-(2-hydroxyethyl)furan-2-yl]acetaldehyde?
The InChIKey is HZDHIONPECPGJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10O3/c9-5-3-7-1-2-8(11-7)4-6-10/h1-2,5,10H,3-4,6H2.
What are the key properties of 2-[5-(2-hydroxyethyl)furan-2-yl]acetaldehyde?
2-[5-(2-hydroxyethyl)furan-2-yl]acetaldehyde has a molecular weight of 154.16 g/mol, XLogP of 0.56, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(2-hydroxyethyl)furan-2-yl]acetaldehyde is sourced from PubChem (CID 153490794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).