4-(3-chlorophenyl)-2-methylfuran

C11H9ClO — CID 69479564

IUPAC4-(3-chlorophenyl)-2-methylfuran
SMILESCc1cc(-c2cccc(Cl)c2)co1
InChIInChI=1S/C11H9ClO/c1-8-5-10(7-13-8)9-3-2-4-11(12)6-9/h2-7H,1H3
InChIKeyVEVOHLPOVXIUIC-UHFFFAOYSA-N
MW192.64 g/mol
LogP3.91
Rot. Bonds1

About 4-(3-chlorophenyl)-2-methylfuran

4-(3-chlorophenyl)-2-methylfuran (PubChem CID 69479564) has the molecular formula C11H9ClO and a molecular weight of 192.64 g/mol. Its IUPAC name is 4-(3-chlorophenyl)-2-methylfuran.

Molecular Properties

Compound Name4-(3-chlorophenyl)-2-methylfuran
PubChem CID69479564
Molecular FormulaC11H9ClO
Molecular Weight192.64 g/mol
Exact Mass192.03
IUPAC Name4-(3-chlorophenyl)-2-methylfuran
SMILESCc1cc(-c2cccc(Cl)c2)co1
InChIInChI=1S/C11H9ClO/c1-8-5-10(7-13-8)9-3-2-4-11(12)6-9/h2-7H,1H3
InChIKeyVEVOHLPOVXIUIC-UHFFFAOYSA-N
XLogP3.91
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.64
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 4-(3-chlorophenyl)-2-methylfuran with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(3-chlorophenyl)furan-2-carbaldehyde
CID 87992814
4-(3-chlorophenyl)-5-(5-methylfuran-3-yl)-1H-pyrazol-3-amine
CID 114821013
4-(3,4-difluorophenyl)-2-methylfuran
CID 69480889
[5-(3-chlorophenyl)-2-methylphenyl]methanamine
CID 115038622
3-(3-chlorophenyl)phenol;ethane
CID 142088616
4-(3-chlorophenyl)-2-methylaniline
CID 23005189
5-(3-chlorophenyl)-2,3-dimethylfuran
CID 90397375
3-(3-chlorophenyl)aniline;hydrochloride
CID 2757424
3-(3-chlorophenyl)-4-methyl-1,2,4-triazole
CID 79002375
1-[3-(3-chlorophenyl)phenyl]ethanone
CID 4304570
6-(3-chlorophenyl)naphthalen-2-amine
CID 172868696
2-(3-chlorophenyl)-1-(5-methylfuran-3-yl)ethanol
CID 114822934

Frequently Asked Questions

What is the IUPAC name of 4-(3-chlorophenyl)-2-methylfuran?
The IUPAC name of 4-(3-chlorophenyl)-2-methylfuran (CID 69479564) is 4-(3-chlorophenyl)-2-methylfuran.
What is the SMILES notation for 4-(3-chlorophenyl)-2-methylfuran?
The canonical SMILES for 4-(3-chlorophenyl)-2-methylfuran is Cc1cc(-c2cccc(Cl)c2)co1.
What is the InChIKey of 4-(3-chlorophenyl)-2-methylfuran?
The InChIKey is VEVOHLPOVXIUIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClO/c1-8-5-10(7-13-8)9-3-2-4-11(12)6-9/h2-7H,1H3.
What are the key properties of 4-(3-chlorophenyl)-2-methylfuran?
4-(3-chlorophenyl)-2-methylfuran has a molecular weight of 192.64 g/mol, XLogP of 3.91, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-chlorophenyl)-2-methylfuran is sourced from PubChem (CID 69479564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).