thiophen-2-ylmethyl furan-2-carboxylate

C10H8O3S — CID 2375148

IUPACthiophen-2-ylmethyl furan-2-carboxylate
SMILESO=C(OCc1cccs1)c1ccco1
InChIInChI=1S/C10H8O3S/c11-10(9-4-1-5-12-9)13-7-8-3-2-6-14-8/h1-6H,7H2
InChIKeyLZRWNUHWWOKSSY-UHFFFAOYSA-N
MW208.24 g/mol
LogP2.70
Rot. Bonds3

About thiophen-2-ylmethyl furan-2-carboxylate

thiophen-2-ylmethyl furan-2-carboxylate (PubChem CID 2375148) has the molecular formula C10H8O3S and a molecular weight of 208.24 g/mol. Its IUPAC name is thiophen-2-ylmethyl furan-2-carboxylate.

Molecular Properties

Compound Namethiophen-2-ylmethyl furan-2-carboxylate
PubChem CID2375148
Molecular FormulaC10H8O3S
Molecular Weight208.24 g/mol
Exact Mass208.02
IUPAC Namethiophen-2-ylmethyl furan-2-carboxylate
SMILESO=C(OCc1cccs1)c1ccco1
InChIInChI=1S/C10H8O3S/c11-10(9-4-1-5-12-9)13-7-8-3-2-6-14-8/h1-6H,7H2
InChIKeyLZRWNUHWWOKSSY-UHFFFAOYSA-N
XLogP2.70
TPSA39.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.24
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of thiophen-2-ylmethyl furan-2-carboxylate?
The IUPAC name of thiophen-2-ylmethyl furan-2-carboxylate (CID 2375148) is thiophen-2-ylmethyl furan-2-carboxylate.
What is the SMILES notation for thiophen-2-ylmethyl furan-2-carboxylate?
The canonical SMILES for thiophen-2-ylmethyl furan-2-carboxylate is O=C(OCc1cccs1)c1ccco1.
What is the InChIKey of thiophen-2-ylmethyl furan-2-carboxylate?
The InChIKey is LZRWNUHWWOKSSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8O3S/c11-10(9-4-1-5-12-9)13-7-8-3-2-6-14-8/h1-6H,7H2.
What are the key properties of thiophen-2-ylmethyl furan-2-carboxylate?
thiophen-2-ylmethyl furan-2-carboxylate has a molecular weight of 208.24 g/mol, XLogP of 2.70, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for thiophen-2-ylmethyl furan-2-carboxylate is sourced from PubChem (CID 2375148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).