2-(4-chloro-2-methylphenyl)-5-methylfuran

C12H11ClO — CID 123392462

IUPAC2-(4-chloro-2-methylphenyl)-5-methylfuran
SMILESCc1ccc(-c2ccc(Cl)cc2C)o1
InChIInChI=1S/C12H11ClO/c1-8-7-10(13)4-5-11(8)12-6-3-9(2)14-12/h3-7H,1-2H3
InChIKeyUXXYSVZEBGHIFY-UHFFFAOYSA-N
MW206.67 g/mol
LogP4.22
Rot. Bonds1

About 2-(4-chloro-2-methylphenyl)-5-methylfuran

2-(4-chloro-2-methylphenyl)-5-methylfuran (PubChem CID 123392462) has the molecular formula C12H11ClO and a molecular weight of 206.67 g/mol. Its IUPAC name is 2-(4-chloro-2-methylphenyl)-5-methylfuran.

Molecular Properties

Compound Name2-(4-chloro-2-methylphenyl)-5-methylfuran
PubChem CID123392462
Molecular FormulaC12H11ClO
Molecular Weight206.67 g/mol
Exact Mass206.05
IUPAC Name2-(4-chloro-2-methylphenyl)-5-methylfuran
SMILESCc1ccc(-c2ccc(Cl)cc2C)o1
InChIInChI=1S/C12H11ClO/c1-8-7-10(13)4-5-11(8)12-6-3-9(2)14-12/h3-7H,1-2H3
InChIKeyUXXYSVZEBGHIFY-UHFFFAOYSA-N
XLogP4.22
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.67
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-bromo-4-chlorophenyl)-5-methylfuran
CID 54858979
2-(2,5-dichlorophenyl)-5-methylfuran;ethane
CID 143821579
N-[[5-(4-chloro-2-methylphenyl)furan-2-yl]methyl]ethanamine
CID 43624933
2,6-difluoro-3-(5-methylfuran-2-yl)aniline
CID 165455091
2,5-bis(2,4-dimethylphenyl)furan
CID 69007867
4-chloro-2-methyl-1-(2-methylphenyl)benzene
CID 70849207
3-(4-chloro-2-methylphenyl)-1-methylpyrazole
CID 176555071
1-(4-chloro-2-methylphenyl)-2,3,4-trimethylbenzene
CID 91338289
[5-(4-chloro-2-methylphenyl)furan-2-yl]-[(2R)-2-methylpiperidin-1-yl]methanone
CID 94076411
5-(5-chloro-2-methylphenyl)furan-2-carbonitrile
CID 82113987
2-chloro-3-(5-methylfuran-2-yl)aniline
CID 130506634
4-chloro-1-(4-fluorophenyl)-2-methylbenzene
CID 46314507

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-2-methylphenyl)-5-methylfuran?
The IUPAC name of 2-(4-chloro-2-methylphenyl)-5-methylfuran (CID 123392462) is 2-(4-chloro-2-methylphenyl)-5-methylfuran.
What is the SMILES notation for 2-(4-chloro-2-methylphenyl)-5-methylfuran?
The canonical SMILES for 2-(4-chloro-2-methylphenyl)-5-methylfuran is Cc1ccc(-c2ccc(Cl)cc2C)o1.
What is the InChIKey of 2-(4-chloro-2-methylphenyl)-5-methylfuran?
The InChIKey is UXXYSVZEBGHIFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClO/c1-8-7-10(13)4-5-11(8)12-6-3-9(2)14-12/h3-7H,1-2H3.
What are the key properties of 2-(4-chloro-2-methylphenyl)-5-methylfuran?
2-(4-chloro-2-methylphenyl)-5-methylfuran has a molecular weight of 206.67 g/mol, XLogP of 4.22, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-2-methylphenyl)-5-methylfuran is sourced from PubChem (CID 123392462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).