3-chlorofuran

C4H3ClO — CID 3016547

IUPAC3-chlorofuran
SMILESClc1ccoc1
InChIInChI=1S/C4H3ClO/c5-4-1-2-6-3-4/h1-3H
InChIKeyJPPBBGANXNRTBE-UHFFFAOYSA-N
MW102.52 g/mol
LogP1.93
Rot. Bonds

About 3-chlorofuran

3-chlorofuran (PubChem CID 3016547) has the molecular formula C4H3ClO and a molecular weight of 102.52 g/mol. Its IUPAC name is 3-chlorofuran.

Molecular Properties

Compound Name3-chlorofuran
PubChem CID3016547
Molecular FormulaC4H3ClO
Molecular Weight102.52 g/mol
Exact Mass101.99
IUPAC Name3-chlorofuran
SMILESClc1ccoc1
InChIInChI=1S/C4H3ClO/c5-4-1-2-6-3-4/h1-3H
InChIKeyJPPBBGANXNRTBE-UHFFFAOYSA-N
XLogP1.93
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.52
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-chlorofuran?
The IUPAC name of 3-chlorofuran (CID 3016547) is 3-chlorofuran.
What is the SMILES notation for 3-chlorofuran?
The canonical SMILES for 3-chlorofuran is Clc1ccoc1.
What is the InChIKey of 3-chlorofuran?
The InChIKey is JPPBBGANXNRTBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H3ClO/c5-4-1-2-6-3-4/h1-3H.
What are the key properties of 3-chlorofuran?
3-chlorofuran has a molecular weight of 102.52 g/mol, XLogP of 1.93, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chlorofuran is sourced from PubChem (CID 3016547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).