2-[(E)-1-chloroprop-1-enyl]furan

C7H7ClO — CID 170605164

IUPAC2-[(E)-1-chloroprop-1-enyl]furan
SMILESC/C=C(/Cl)c1ccco1
InChIInChI=1S/C7H7ClO/c1-2-6(8)7-4-3-5-9-7/h2-5H,1H3/b6-2+
InChIKeyJQFGCKPIOMZJLR-QHHAFSJGSA-N
MW142.58 g/mol
LogP2.88
Rot. Bonds1

About 2-[(E)-1-chloroprop-1-enyl]furan

2-[(E)-1-chloroprop-1-enyl]furan (PubChem CID 170605164) has the molecular formula C7H7ClO and a molecular weight of 142.58 g/mol. Its IUPAC name is 2-[(E)-1-chloroprop-1-enyl]furan.

Molecular Properties

Compound Name2-[(E)-1-chloroprop-1-enyl]furan
PubChem CID170605164
Molecular FormulaC7H7ClO
Molecular Weight142.58 g/mol
Exact Mass142.02
IUPAC Name2-[(E)-1-chloroprop-1-enyl]furan
SMILESC/C=C(/Cl)c1ccco1
InChIInChI=1S/C7H7ClO/c1-2-6(8)7-4-3-5-9-7/h2-5H,1H3/b6-2+
InChIKeyJQFGCKPIOMZJLR-QHHAFSJGSA-N
XLogP2.88
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.58
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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(E)-1-(furan-2-yl)pent-3-ene-1,2-dione
CID 70521586
bis((NZ)-N-[(2Z)-1,2-bis(furan-2-yl)-2-hydroxyiminoethylidene]hydroxylamine);copper
CID 135436493
furan-2-carboxylic acid;methanol
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N-[(E)-prop-1-enyl]furan-2-carboxamide
CID 131242879
2-[(3E)-4-methylhexa-1,3,5-trien-3-yl]furan
CID 155692254
furan-2-carboxylic acid;methanamine
CID 82372767
[furan-2-yl(hydroxy)methylidene]chromium
CID 11728114
1,3-bis(furan-2-yl)-2-methylpropane-1,3-dione
CID 15262340
N-chlorofuran-2-carboxamide
CID 18537247
furan-2-carboxylic acid;gold
CID 174701575

Frequently Asked Questions

What is the IUPAC name of 2-[(E)-1-chloroprop-1-enyl]furan?
The IUPAC name of 2-[(E)-1-chloroprop-1-enyl]furan (CID 170605164) is 2-[(E)-1-chloroprop-1-enyl]furan.
What is the SMILES notation for 2-[(E)-1-chloroprop-1-enyl]furan?
The canonical SMILES for 2-[(E)-1-chloroprop-1-enyl]furan is C/C=C(/Cl)c1ccco1.
What is the InChIKey of 2-[(E)-1-chloroprop-1-enyl]furan?
The InChIKey is JQFGCKPIOMZJLR-QHHAFSJGSA-N. The full InChI is InChI=1S/C7H7ClO/c1-2-6(8)7-4-3-5-9-7/h2-5H,1H3/b6-2+.
What are the key properties of 2-[(E)-1-chloroprop-1-enyl]furan?
2-[(E)-1-chloroprop-1-enyl]furan has a molecular weight of 142.58 g/mol, XLogP of 2.88, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-1-chloroprop-1-enyl]furan is sourced from PubChem (CID 170605164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).