8-methyl-5,6,7,8-tetrahydronaphthalene-1,7-diol

C11H14O2 — CID 115010745

IUPAC8-methyl-5,6,7,8-tetrahydronaphthalene-1,7-diol
SMILESCC1c2c(O)cccc2CCC1O
InChIInChI=1S/C11H14O2/c1-7-9(12)6-5-8-3-2-4-10(13)11(7)8/h2-4,7,9,12-13H,5-6H2,1H3
InChIKeyNDAFWSULRFYSIJ-UHFFFAOYSA-N
MW178.23 g/mol
LogP1.80
Rot. Bonds

About 8-methyl-5,6,7,8-tetrahydronaphthalene-1,7-diol

8-methyl-5,6,7,8-tetrahydronaphthalene-1,7-diol (PubChem CID 115010745) has the molecular formula C11H14O2 and a molecular weight of 178.23 g/mol. Its IUPAC name is 8-methyl-5,6,7,8-tetrahydronaphthalene-1,7-diol.

Molecular Properties

Compound Name8-methyl-5,6,7,8-tetrahydronaphthalene-1,7-diol
PubChem CID115010745
Molecular FormulaC11H14O2
Molecular Weight178.23 g/mol
Exact Mass178.10
IUPAC Name8-methyl-5,6,7,8-tetrahydronaphthalene-1,7-diol
SMILESCC1c2c(O)cccc2CCC1O
InChIInChI=1S/C11H14O2/c1-7-9(12)6-5-8-3-2-4-10(13)11(7)8/h2-4,7,9,12-13H,5-6H2,1H3
InChIKeyNDAFWSULRFYSIJ-UHFFFAOYSA-N
XLogP1.80
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-2,3-dihydro-1H-inden-4-ol
CID 13376843
(7R,8R)-7-(dipropylamino)-8-methyl-5,6,7,8-tetrahydronaphthalen-1-ol;hydrochloride
CID 73349829
(3S)-3-(methylamino)-2,3-dihydro-1H-inden-4-ol
CID 129390412
(1S)-1-methyl-1,2,3,4-tetrahydroisoquinolin-8-ol
CID 96972246
(1S)-7-hydroxy-2,3-dihydro-1H-indene-1-carboxylic acid
CID 124547289
(1S)-7-bromo-2,3-dihydro-1H-inden-1-ol
CID 129246818
(1R,2S)-8-chloro-1,2,3,4-tetrahydronaphthalene-1,2-diol
CID 134294877
(8R)-8-amino-5,6,7,8-tetrahydronaphthalen-1-ol
CID 130673743
1-methyl-1,2,3,4-tetrahydronaphthalene-2,7-diol
CID 115010784
7-(hydroxymethyl)-2,3-dihydro-1H-inden-1-ol
CID 15329434
8-(1-aminoethyl)-5,6,7,8-tetrahydronaphthalen-1-ol
CID 105445428
6-fluoro-1-methyl-1,2,3,4-tetrahydronaphthalen-2-ol
CID 115010803

Frequently Asked Questions

What is the IUPAC name of 8-methyl-5,6,7,8-tetrahydronaphthalene-1,7-diol?
The IUPAC name of 8-methyl-5,6,7,8-tetrahydronaphthalene-1,7-diol (CID 115010745) is 8-methyl-5,6,7,8-tetrahydronaphthalene-1,7-diol.
What is the SMILES notation for 8-methyl-5,6,7,8-tetrahydronaphthalene-1,7-diol?
The canonical SMILES for 8-methyl-5,6,7,8-tetrahydronaphthalene-1,7-diol is CC1c2c(O)cccc2CCC1O.
What is the InChIKey of 8-methyl-5,6,7,8-tetrahydronaphthalene-1,7-diol?
The InChIKey is NDAFWSULRFYSIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O2/c1-7-9(12)6-5-8-3-2-4-10(13)11(7)8/h2-4,7,9,12-13H,5-6H2,1H3.
What are the key properties of 8-methyl-5,6,7,8-tetrahydronaphthalene-1,7-diol?
8-methyl-5,6,7,8-tetrahydronaphthalene-1,7-diol has a molecular weight of 178.23 g/mol, XLogP of 1.80, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-5,6,7,8-tetrahydronaphthalene-1,7-diol is sourced from PubChem (CID 115010745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).