3-methoxy-5H-indene

C10H10O — CID 57180917

IUPAC3-methoxy-5H-indene
SMILESCOC1=CC=C2C=CCC=C21
InChIInChI=1S/C10H10O/c1-11-10-7-6-8-4-2-3-5-9(8)10/h2,4-7H,3H2,1H3
InChIKeySXGIIOKFIUYIHF-UHFFFAOYSA-N
MW146.19 g/mol
LogP2.34
Rot. Bonds1

About 3-methoxy-5H-indene

3-methoxy-5H-indene (PubChem CID 57180917) has the molecular formula C10H10O and a molecular weight of 146.19 g/mol. Its IUPAC name is 3-methoxy-5H-indene.

Molecular Properties

Compound Name3-methoxy-5H-indene
PubChem CID57180917
Molecular FormulaC10H10O
Molecular Weight146.19 g/mol
Exact Mass146.07
IUPAC Name3-methoxy-5H-indene
SMILESCOC1=CC=C2C=CCC=C21
InChIInChI=1S/C10H10O/c1-11-10-7-6-8-4-2-3-5-9(8)10/h2,4-7H,3H2,1H3
InChIKeySXGIIOKFIUYIHF-UHFFFAOYSA-N
XLogP2.34
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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Lithium 1-methoxy-3-methylbenzene-4-ide
CID 14790499
7-Tetrahydrobenzofuran
CID 17799099
7,7a-Dihydrobenzofuran
CID 19744327
Fluoreno[1,2-b]pyran
CID 22497284
Dihydrocyclopenta(C)pyrane
CID 67724778
Cyclopentabenzofuran
CID 87131369
Cyclopentachromene
CID 87622378
Indenobenzofuran
CID 88598125
Cyclopenta-[g]-benzo pyrane
CID 89428281
1,3-Dimethoxy-3-methylbenzene
CID 129707622

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-5H-indene?
The IUPAC name of 3-methoxy-5H-indene (CID 57180917) is 3-methoxy-5H-indene.
What is the SMILES notation for 3-methoxy-5H-indene?
The canonical SMILES for 3-methoxy-5H-indene is COC1=CC=C2C=CCC=C21.
What is the InChIKey of 3-methoxy-5H-indene?
The InChIKey is SXGIIOKFIUYIHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10O/c1-11-10-7-6-8-4-2-3-5-9(8)10/h2,4-7H,3H2,1H3.
What are the key properties of 3-methoxy-5H-indene?
3-methoxy-5H-indene has a molecular weight of 146.19 g/mol, XLogP of 2.34, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-5H-indene is sourced from PubChem (CID 57180917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).