5-propyl-1,3-dihydro-2-benzofuran

C11H14O — CID 12955167

IUPAC5-propyl-1,3-dihydro-2-benzofuran
SMILESCCCc1ccc2c(c1)COC2
InChIInChI=1S/C11H14O/c1-2-3-9-4-5-10-7-12-8-11(10)6-9/h4-6H,2-3,7-8H2,1H3
InChIKeyYDEXEYXFAWWTMM-UHFFFAOYSA-N
MW162.23 g/mol
LogP2.67
Rot. Bonds2

About 5-propyl-1,3-dihydro-2-benzofuran

5-propyl-1,3-dihydro-2-benzofuran (PubChem CID 12955167) has the molecular formula C11H14O and a molecular weight of 162.23 g/mol. Its IUPAC name is 5-propyl-1,3-dihydro-2-benzofuran.

Molecular Properties

Compound Name5-propyl-1,3-dihydro-2-benzofuran
PubChem CID12955167
Molecular FormulaC11H14O
Molecular Weight162.23 g/mol
Exact Mass162.10
IUPAC Name5-propyl-1,3-dihydro-2-benzofuran
SMILESCCCc1ccc2c(c1)COC2
InChIInChI=1S/C11H14O/c1-2-3-9-4-5-10-7-12-8-11(10)6-9/h4-6H,2-3,7-8H2,1H3
InChIKeyYDEXEYXFAWWTMM-UHFFFAOYSA-N
XLogP2.67
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.23
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,4-Bis(Methoxymethyl)Benzene
CID 81239
Benzenemethanol, 2,4-dimethyl-, 1-acetate
CID 94602
1,3-Dihydroisobenzofuran
CID 10327
1-(2-Methoxypropan-2-yl)-4-methylbenzene
CID 14121774
1,3-Dimethoxyphthalan
CID 11629690
4-(2-Methylpropyl)benzyl propyl ether
CID 122553315
1-(Ethoxymethyl)-4-methylbenzene
CID 12727419
(1,3-Dihydro-2-benzofuran-5-yl)methanol
CID 19809558
3,4-Dimethylstyrene oxide
CID 159631
1,4-Dihydro-1,4-epoxynaphthalene
CID 97139
Allyl p-methylbenzyl ether
CID 570621
Benzene, (methoxymethyl)methyl-
CID 76933

Frequently Asked Questions

What is the IUPAC name of 5-propyl-1,3-dihydro-2-benzofuran?
The IUPAC name of 5-propyl-1,3-dihydro-2-benzofuran (CID 12955167) is 5-propyl-1,3-dihydro-2-benzofuran.
What is the SMILES notation for 5-propyl-1,3-dihydro-2-benzofuran?
The canonical SMILES for 5-propyl-1,3-dihydro-2-benzofuran is CCCc1ccc2c(c1)COC2.
What is the InChIKey of 5-propyl-1,3-dihydro-2-benzofuran?
The InChIKey is YDEXEYXFAWWTMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O/c1-2-3-9-4-5-10-7-12-8-11(10)6-9/h4-6H,2-3,7-8H2,1H3.
What are the key properties of 5-propyl-1,3-dihydro-2-benzofuran?
5-propyl-1,3-dihydro-2-benzofuran has a molecular weight of 162.23 g/mol, XLogP of 2.67, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propyl-1,3-dihydro-2-benzofuran is sourced from PubChem (CID 12955167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).