3-(2-ethylphenyl)furan

C12H12O — CID 146186542

IUPAC3-(2-ethylphenyl)furan
SMILESCCc1ccccc1-c1ccoc1
InChIInChI=1S/C12H12O/c1-2-10-5-3-4-6-12(10)11-7-8-13-9-11/h3-9H,2H2,1H3
InChIKeyYVYFGXGWUVYLSS-UHFFFAOYSA-N
MW172.23 g/mol
LogP3.51
Rot. Bonds2

About 3-(2-ethylphenyl)furan

3-(2-ethylphenyl)furan (PubChem CID 146186542) has the molecular formula C12H12O and a molecular weight of 172.23 g/mol. Its IUPAC name is 3-(2-ethylphenyl)furan.

Molecular Properties

Compound Name3-(2-ethylphenyl)furan
PubChem CID146186542
Molecular FormulaC12H12O
Molecular Weight172.23 g/mol
Exact Mass172.09
IUPAC Name3-(2-ethylphenyl)furan
SMILESCCc1ccccc1-c1ccoc1
InChIInChI=1S/C12H12O/c1-2-10-5-3-4-6-12(10)11-7-8-13-9-11/h3-9H,2H2,1H3
InChIKeyYVYFGXGWUVYLSS-UHFFFAOYSA-N
XLogP3.51
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-(2-methylphenyl)furan
CID 12768223
N-[[2-(furan-3-yl)phenyl]methyl]cyclopropanamine
CID 63948734
2-(furan-3-yl)phenol
CID 22723440
acetic acid;1-ethyl-2-phenylbenzene
CID 67681814
5-(2-ethylphenyl)benzene-1,3-diol
CID 101302537
ethane;3-phenylfuran
CID 91349399
N-[(2-ethylphenyl)methyl]-1-(furan-3-yl)methanamine
CID 64681981
(1S,5R)-3-[[2-(furan-3-yl)phenyl]methoxy]-8-azabicyclo[3.2.1]octane;hydrochloride
CID 68676795
3-(furan-3-yl)-1H-pyridin-2-one
CID 10374724
benzoic acid;1-ethyl-2-phenylbenzene
CID 66846233
1,2-dichloro-4-(2-ethylphenyl)benzene
CID 67818201
1-ethyl-2-[2-(2-phenylphenyl)ethyl]benzene
CID 173431013

Frequently Asked Questions

What is the IUPAC name of 3-(2-ethylphenyl)furan?
The IUPAC name of 3-(2-ethylphenyl)furan (CID 146186542) is 3-(2-ethylphenyl)furan.
What is the SMILES notation for 3-(2-ethylphenyl)furan?
The canonical SMILES for 3-(2-ethylphenyl)furan is CCc1ccccc1-c1ccoc1.
What is the InChIKey of 3-(2-ethylphenyl)furan?
The InChIKey is YVYFGXGWUVYLSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12O/c1-2-10-5-3-4-6-12(10)11-7-8-13-9-11/h3-9H,2H2,1H3.
What are the key properties of 3-(2-ethylphenyl)furan?
3-(2-ethylphenyl)furan has a molecular weight of 172.23 g/mol, XLogP of 3.51, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethylphenyl)furan is sourced from PubChem (CID 146186542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).