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

C9H10O — CID 12725190

IUPAC5-methyl-2,3-dihydro-1-benzofuran
SMILESCc1ccc2c(c1)CCO2
InChIInChI=1S/C9H10O/c1-7-2-3-9-8(6-7)4-5-10-9/h2-3,6H,4-5H2,1H3
InChIKeyOLHBKXYPKCHVNW-UHFFFAOYSA-N
MW134.18 g/mol
LogP1.93
Rot. Bonds

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

5-methyl-2,3-dihydro-1-benzofuran (PubChem CID 12725190) has the molecular formula C9H10O and a molecular weight of 134.18 g/mol. Its IUPAC name is 5-methyl-2,3-dihydro-1-benzofuran.

Molecular Properties

Compound Name5-methyl-2,3-dihydro-1-benzofuran
PubChem CID12725190
Molecular FormulaC9H10O
Molecular Weight134.18 g/mol
Exact Mass134.07
IUPAC Name5-methyl-2,3-dihydro-1-benzofuran
SMILESCc1ccc2c(c1)CCO2
InChIInChI=1S/C9H10O/c1-7-2-3-9-8(6-7)4-5-10-9/h2-3,6H,4-5H2,1H3
InChIKeyOLHBKXYPKCHVNW-UHFFFAOYSA-N
XLogP1.93
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;5-methyl-2,3-dihydro-1-benzofuran;propane
CID 145162253
ethane;7-methyl-2,3,4,5-tetrahydro-1-benzoxepine
CID 143911353
5-methyl-1,3-dihydro-2-benzofuran;5-methyl-2,3-dihydro-1-benzofuran;6-methyl-2,3-dihydro-1-benzofuran
CID 143949912
2-(2,3-dihydro-1-benzofuran-5-yl)-5-methylaniline
CID 82766457
5-(4-methylphenyl)sulfonyl-2,3-dihydro-1-benzofuran
CID 23543562
5-[chloro-(2,4-dimethylphenyl)methyl]-2,3-dihydro-1-benzofuran
CID 63429922
(1R)-N-[1-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-1-(4-methylphenyl)ethanamine
CID 81347474
1-(2,3-dihydro-1-benzofuran-5-yl)-N-methyl-1-(4-methylphenyl)methanamine
CID 43482586
5-[bromo-(2-bromo-5-methylphenyl)methyl]-2,3-dihydro-1-benzofuran
CID 81112440
2,3-dihydro-1-benzofuran-5-yl-(3-methylphenyl)methanol
CID 61100251
2-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]-5-methylaniline
CID 65430830
2,3-dihydro-1-benzofuran-5-yl-(3,5-dimethylphenyl)methanamine
CID 43198444

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2,3-dihydro-1-benzofuran?
The IUPAC name of 5-methyl-2,3-dihydro-1-benzofuran (CID 12725190) is 5-methyl-2,3-dihydro-1-benzofuran.
What is the SMILES notation for 5-methyl-2,3-dihydro-1-benzofuran?
The canonical SMILES for 5-methyl-2,3-dihydro-1-benzofuran is Cc1ccc2c(c1)CCO2.
What is the InChIKey of 5-methyl-2,3-dihydro-1-benzofuran?
The InChIKey is OLHBKXYPKCHVNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10O/c1-7-2-3-9-8(6-7)4-5-10-9/h2-3,6H,4-5H2,1H3.
What are the key properties of 5-methyl-2,3-dihydro-1-benzofuran?
5-methyl-2,3-dihydro-1-benzofuran has a molecular weight of 134.18 g/mol, XLogP of 1.93, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2,3-dihydro-1-benzofuran is sourced from PubChem (CID 12725190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).