2-(3-chloro-4-propoxyphenyl)furan

C13H13ClO2 — CID 168525179

IUPAC2-(3-chloro-4-propoxyphenyl)furan
SMILESCCCOc1ccc(-c2ccco2)cc1Cl
InChIInChI=1S/C13H13ClO2/c1-2-7-15-13-6-5-10(9-11(13)14)12-4-3-8-16-12/h3-6,8-9H,2,7H2,1H3
InChIKeyKTHYBRZTDLIYME-UHFFFAOYSA-N
MW236.70 g/mol
LogP4.39
Rot. Bonds4

About 2-(3-chloro-4-propoxyphenyl)furan

2-(3-chloro-4-propoxyphenyl)furan (PubChem CID 168525179) has the molecular formula C13H13ClO2 and a molecular weight of 236.70 g/mol. Its IUPAC name is 2-(3-chloro-4-propoxyphenyl)furan.

Molecular Properties

Compound Name2-(3-chloro-4-propoxyphenyl)furan
PubChem CID168525179
Molecular FormulaC13H13ClO2
Molecular Weight236.70 g/mol
Exact Mass236.06
IUPAC Name2-(3-chloro-4-propoxyphenyl)furan
SMILESCCCOc1ccc(-c2ccco2)cc1Cl
InChIInChI=1S/C13H13ClO2/c1-2-7-15-13-6-5-10(9-11(13)14)12-4-3-8-16-12/h3-6,8-9H,2,7H2,1H3
InChIKeyKTHYBRZTDLIYME-UHFFFAOYSA-N
XLogP4.39
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.70
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[3-chloro-4-(4-methoxyphenoxy)phenyl]furan
CID 168527146
3-chloro-2-[2-chloro-4-(furan-2-yl)phenoxy]-5-(trifluoromethyl)pyridine
CID 168527041
CID 174570347
CID 174570347
2-(3-bromo-5-chloro-4-ethoxyphenyl)furan
CID 168524802
1-[2-ethoxy-5-(furan-2-yl)phenyl]pyrrole
CID 168525775
2-[4-(2,4-dichlorophenoxy)phenyl]furan
CID 168526554
2-chloro-1-propoxy-4-propylbenzene;ethane
CID 143012036
2-[2-chloro-4-(furan-2-yl)phenoxy]-6-(trifluoromethyl)pyridine
CID 168525596
4-[5-(3-chloro-4-propoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-iodophenol
CID 136509861
methyl 2-chloro-5-(furan-2-yl)benzoate
CID 168524498
(1S)-1-[3-chloro-4-(furan-2-ylmethoxy)phenyl]ethanamine
CID 78937702
N-[2-(2-chloro-4-phenylphenoxy)ethyl]butan-1-amine
CID 63506720

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-4-propoxyphenyl)furan?
The IUPAC name of 2-(3-chloro-4-propoxyphenyl)furan (CID 168525179) is 2-(3-chloro-4-propoxyphenyl)furan.
What is the SMILES notation for 2-(3-chloro-4-propoxyphenyl)furan?
The canonical SMILES for 2-(3-chloro-4-propoxyphenyl)furan is CCCOc1ccc(-c2ccco2)cc1Cl.
What is the InChIKey of 2-(3-chloro-4-propoxyphenyl)furan?
The InChIKey is KTHYBRZTDLIYME-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClO2/c1-2-7-15-13-6-5-10(9-11(13)14)12-4-3-8-16-12/h3-6,8-9H,2,7H2,1H3.
What are the key properties of 2-(3-chloro-4-propoxyphenyl)furan?
2-(3-chloro-4-propoxyphenyl)furan has a molecular weight of 236.70 g/mol, XLogP of 4.39, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-4-propoxyphenyl)furan is sourced from PubChem (CID 168525179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).