3-methyl-1H-indene

C10H10 — CID 13025

IUPAC3-methyl-1H-indene
SMILESCC1=CCc2ccccc21
InChIInChI=1S/C10H10/c1-8-6-7-9-4-2-3-5-10(8)9/h2-6H,7H2,1H3
InChIKeyCOOKKJGOGWACMY-UHFFFAOYSA-N
MW130.19 g/mol
LogP2.65
Rot. Bonds

About 3-methyl-1H-indene

3-methyl-1H-indene (PubChem CID 13025) has the molecular formula C10H10 and a molecular weight of 130.19 g/mol. Its IUPAC name is 3-methyl-1H-indene.

Molecular Properties

Compound Name3-methyl-1H-indene
PubChem CID13025
Molecular FormulaC10H10
Molecular Weight130.19 g/mol
Exact Mass130.08
IUPAC Name3-methyl-1H-indene
SMILESCC1=CCc2ccccc21
InChIInChI=1S/C10H10/c1-8-6-7-9-4-2-3-5-10(8)9/h2-6H,7H2,1H3
InChIKeyCOOKKJGOGWACMY-UHFFFAOYSA-N
XLogP2.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

Biphenyl
CID 7095
Toluene
CID 1140
Fluorene
CID 6853
O-Xylene
CID 7237
Alpha-Methylstyrene
CID 7407
Ethylbenzene
CID 7500
Styrene
CID 7501
M-Xylene
CID 7929
P-Xylene
CID 7809
Tetralin
CID 8404
P-Cymene
CID 7463
Indene
CID 7219

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1H-indene?
The IUPAC name of 3-methyl-1H-indene (CID 13025) is 3-methyl-1H-indene.
What is the SMILES notation for 3-methyl-1H-indene?
The canonical SMILES for 3-methyl-1H-indene is CC1=CCc2ccccc21.
What is the InChIKey of 3-methyl-1H-indene?
The InChIKey is COOKKJGOGWACMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10/c1-8-6-7-9-4-2-3-5-10(8)9/h2-6H,7H2,1H3.
What are the key properties of 3-methyl-1H-indene?
3-methyl-1H-indene has a molecular weight of 130.19 g/mol, XLogP of 2.65, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1H-indene is sourced from PubChem (CID 13025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).