2,3-dihydrobenzofuran

2,3-dihydrobenzofuran
Compound Structure:
Synonyms: 2,3-DIHYDROBENZOFURAN;Coumaran;2,3-dihydrobenzo[b]furan;2,3-Dihydro-1-benzofuran;Benzofuran, 2,3-dihydro-;Dihydrobenzofuran;Dihydrocoumarone;2,3-Dihydro-benzofuran;Kumaran;2,3-dihydrobenzofurane;2,3-dihydrobenzo(b)furan
Compound ID: NMPC-162
PubChem ID:

10329
Molecular Formula: C8H8O
Canonical SMILES: C1COC2=CC=CC=C21
InChIKey: HBEDSQVIWPRPAY-UHFFFAOYSA-N
About the compound:

2,3-dihydrobenzofuran is a chemical compound that belongs to the class of 1-benzofurans. It is characterized by being a 2,3-dihydro derivative of benzofuran. This compound serves a role as a metabolite, meaning it is involved in various metabolic processes. 2,3-dihydrobenzofuran has been found in several organisms, including Phyla nodiflora (a plant species) and Vitis vinifera (the common grapevine). The presence of this compound in these organisms might have specific biological or metabolic significance, which can vary depending on the species and context in which it is found. Metabolites like 2,3-dihydrobenzofuran are often important intermediates or byproducts of various metabolic pathways. 
Properties:

Chemical and Physical Properties

Property Name

Property Value

Molecular Weight

120.15 g/mol

XLogP3

2.1

Hydrogen Bond Donor Count

0

Hydrogen Bond Acceptor Count

1

Rotatable Bond Count

0

Exact Mass

120.057514874 g/mol

Monoisotopic Mass

120.057514874 g/mol

Topological Polar Surface Area

9.2Ų

Heavy Atom Count

9

Formal Charge

0

Complexity

101

Isotope Atom Count

0

Defined Atom Stereocenter Count

0

Undefined Atom Stereocenter Count

0

Defined Bond Stereocenter Count

0

Undefined Bond Stereocenter Count

0

Covalently-Bonded Unit Count

1

Compound Is Canonicalized

Yes

Physical Description

Liquid

Boiling Point

188.00 to 189.00 °C. @ 760.00 mm Hg

Melting Point

-21.5 °C

Source: PubChem
Source Species: Vernonia blumeoides
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