ethane;3-ethyl-6-methyl-1H-indene;methanol

C15H24O — CID 91275305

IUPACethane;3-ethyl-6-methyl-1H-indene;methanol
SMILESCC.CCC1=CCc2cc(C)ccc21.CO
InChIInChI=1S/C12H14.C2H6.CH4O/c1-3-10-5-6-11-8-9(2)4-7-12(10)11;2*1-2/h4-5,7-8H,3,6H2,1-2H3;1-2H3;2H,1H3
InChIKeyTYKFUBRGHYIONO-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.98
Rot. Bonds1

About ethane;3-ethyl-6-methyl-1H-indene;methanol

ethane;3-ethyl-6-methyl-1H-indene;methanol (PubChem CID 91275305) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is ethane;3-ethyl-6-methyl-1H-indene;methanol.

Molecular Properties

Compound Nameethane;3-ethyl-6-methyl-1H-indene;methanol
PubChem CID91275305
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Nameethane;3-ethyl-6-methyl-1H-indene;methanol
SMILESCC.CCC1=CCc2cc(C)ccc21.CO
InChIInChI=1S/C12H14.C2H6.CH4O/c1-3-10-5-6-11-8-9(2)4-7-12(10)11;2*1-2/h4-5,7-8H,3,6H2,1-2H3;1-2H3;2H,1H3
InChIKeyTYKFUBRGHYIONO-UHFFFAOYSA-N
XLogP3.98
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of ethane;3-ethyl-6-methyl-1H-indene;methanol?
The IUPAC name of ethane;3-ethyl-6-methyl-1H-indene;methanol (CID 91275305) is ethane;3-ethyl-6-methyl-1H-indene;methanol.
What is the SMILES notation for ethane;3-ethyl-6-methyl-1H-indene;methanol?
The canonical SMILES for ethane;3-ethyl-6-methyl-1H-indene;methanol is CC.CCC1=CCc2cc(C)ccc21.CO.
What is the InChIKey of ethane;3-ethyl-6-methyl-1H-indene;methanol?
The InChIKey is TYKFUBRGHYIONO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14.C2H6.CH4O/c1-3-10-5-6-11-8-9(2)4-7-12(10)11;2*1-2/h4-5,7-8H,3,6H2,1-2H3;1-2H3;2H,1H3.
What are the key properties of ethane;3-ethyl-6-methyl-1H-indene;methanol?
ethane;3-ethyl-6-methyl-1H-indene;methanol has a molecular weight of 220.36 g/mol, XLogP of 3.98, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-ethyl-6-methyl-1H-indene;methanol is sourced from PubChem (CID 91275305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).