(7-methyl-2,3-dihydro-1H-inden-4-yl)methanol

C11H14O — CID 117276140

IUPAC(7-methyl-2,3-dihydro-1H-inden-4-yl)methanol
SMILESCc1ccc(CO)c2c1CCC2
InChIInChI=1S/C11H14O/c1-8-5-6-9(7-12)11-4-2-3-10(8)11/h5-6,12H,2-4,7H2,1H3
InChIKeySXJYDOWLOAMWTB-UHFFFAOYSA-N
MW162.23 g/mol
LogP1.98
Rot. Bonds1

About (7-methyl-2,3-dihydro-1H-inden-4-yl)methanol

(7-methyl-2,3-dihydro-1H-inden-4-yl)methanol (PubChem CID 117276140) has the molecular formula C11H14O and a molecular weight of 162.23 g/mol. Its IUPAC name is (7-methyl-2,3-dihydro-1H-inden-4-yl)methanol.

Molecular Properties

Compound Name(7-methyl-2,3-dihydro-1H-inden-4-yl)methanol
PubChem CID117276140
Molecular FormulaC11H14O
Molecular Weight162.23 g/mol
Exact Mass162.10
IUPAC Name(7-methyl-2,3-dihydro-1H-inden-4-yl)methanol
SMILESCc1ccc(CO)c2c1CCC2
InChIInChI=1S/C11H14O/c1-8-5-6-9(7-12)11-4-2-3-10(8)11/h5-6,12H,2-4,7H2,1H3
InChIKeySXJYDOWLOAMWTB-UHFFFAOYSA-N
XLogP1.98
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.23
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (7-methyl-2,3-dihydro-1H-inden-4-yl)methanol?
The IUPAC name of (7-methyl-2,3-dihydro-1H-inden-4-yl)methanol (CID 117276140) is (7-methyl-2,3-dihydro-1H-inden-4-yl)methanol.
What is the SMILES notation for (7-methyl-2,3-dihydro-1H-inden-4-yl)methanol?
The canonical SMILES for (7-methyl-2,3-dihydro-1H-inden-4-yl)methanol is Cc1ccc(CO)c2c1CCC2.
What is the InChIKey of (7-methyl-2,3-dihydro-1H-inden-4-yl)methanol?
The InChIKey is SXJYDOWLOAMWTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O/c1-8-5-6-9(7-12)11-4-2-3-10(8)11/h5-6,12H,2-4,7H2,1H3.
What are the key properties of (7-methyl-2,3-dihydro-1H-inden-4-yl)methanol?
(7-methyl-2,3-dihydro-1H-inden-4-yl)methanol has a molecular weight of 162.23 g/mol, XLogP of 1.98, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (7-methyl-2,3-dihydro-1H-inden-4-yl)methanol is sourced from PubChem (CID 117276140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).