Heptanoic acid, 2-furanylmethyl ester structure

Heptanoic acid, 2-furanylmethyl ester

furan-2-ylmethyl heptanoate

Also Known As: Furfuryl heptanoate|furan-2-ylmethyl heptanoate|2-Furylmethyl heptanoate|FURFURYLHEPTANOATE|2-Furanylmethyl heptanoate|2-Furylmethyl heptanoate #|Furfuryl heptanoate, >=98%|Heptanoic acid, furfuryl ester|(Furan-2-yl)methyl heptanoate|Heptanoic acid, 2-furanylmethyl ester|Heptanoic acid,2-furanylmethyl ester|609-701-1

CAS: 39731-76-5
Molecular Formula C12H18O3
Molecular Weight 210.1256 g/mol
LogP 3.2
Topological Polar Surface Area 39.4 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
Rotatable Bonds 8
Exact Mass 210.1256
Monoisotopic Mass 210.1256
Heavy Atoms 15
Complexity 180.0

Chemical Identifiers

CAS Number 39731-76-5
SMILES CCCCCCC(=O)OCC1=CC=CO1
InChIKey VZRGLBPRLIGTPE-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.

Peptides & Amino Acids (2 patents) Pharmaceutical Intermediates (6 patents)

Product Overview

Heptanoic acid, 2-furanylmethyl ester (CAS 39731-76-5), with molecular formula C12H18O3 and molecular weight 210.1256 g/mol. IUPAC: furan-2-ylmethyl heptanoate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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