1-methyl-2,3-dihydroindene-1,7-diol

C10H12O2 — CID 175232410

IUPAC1-methyl-2,3-dihydroindene-1,7-diol
SMILESCC1(O)CCc2cccc(O)c21
InChIInChI=1S/C10H12O2/c1-10(12)6-5-7-3-2-4-8(11)9(7)10/h2-4,11-12H,5-6H2,1H3
InChIKeyGPYBPRYIQAVBEI-UHFFFAOYSA-N
MW164.20 g/mol
LogP1.55
Rot. Bonds

About 1-methyl-2,3-dihydroindene-1,7-diol

1-methyl-2,3-dihydroindene-1,7-diol (PubChem CID 175232410) has the molecular formula C10H12O2 and a molecular weight of 164.20 g/mol. Its IUPAC name is 1-methyl-2,3-dihydroindene-1,7-diol.

Molecular Properties

Compound Name1-methyl-2,3-dihydroindene-1,7-diol
PubChem CID175232410
Molecular FormulaC10H12O2
Molecular Weight164.20 g/mol
Exact Mass164.08
IUPAC Name1-methyl-2,3-dihydroindene-1,7-diol
SMILESCC1(O)CCc2cccc(O)c21
InChIInChI=1S/C10H12O2/c1-10(12)6-5-7-3-2-4-8(11)9(7)10/h2-4,11-12H,5-6H2,1H3
InChIKeyGPYBPRYIQAVBEI-UHFFFAOYSA-N
XLogP1.55
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.20
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 3-hydroxy-3-methyl-1,2-dihydroindene-4-carboxylate
CID 11085000
8-hydroxy-1,1-dimethyl-3,4-dihydronaphthalen-2-one
CID 115010908
3,3'-spirobi[1,2-dihydroindene]-4-ol
CID 162403250
(2R)-2-hydroxy-2-methyl-3,4-dihydronaphthalen-1-one
CID 14120941
3-methoxy-3-(trifluoromethyl)-1,2-dihydroinden-4-ol
CID 84736310
spiro[1,2-dihydroisoindole-3,1'-cyclopropane]-4-ol
CID 115012660
(3R)-spiro[1,2-dihydroindene-3,2'-pyrrolidine]-4-ol
CID 175046084
3-methyl-3-(trifluoromethyl)-1H-2-benzofuran-4-ol
CID 118030767
2-(1-hydroxycyclopentyl)benzene-1,3-diol
CID 117104102
2-(8-hydroxyspiro[3,4-dihydro-2H-naphthalene-1,1'-cyclopropane]-2-yl)acetic acid
CID 115057219
7-(aminomethyl)spiro[6,7-dihydro-5H-naphthalene-8,1'-cyclobutane]-1-ol
CID 115057224
5-methyl-6,7,8,9-tetrahydrobenzo[7]annulen-5-ol
CID 15751789

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2,3-dihydroindene-1,7-diol?
The IUPAC name of 1-methyl-2,3-dihydroindene-1,7-diol (CID 175232410) is 1-methyl-2,3-dihydroindene-1,7-diol.
What is the SMILES notation for 1-methyl-2,3-dihydroindene-1,7-diol?
The canonical SMILES for 1-methyl-2,3-dihydroindene-1,7-diol is CC1(O)CCc2cccc(O)c21.
What is the InChIKey of 1-methyl-2,3-dihydroindene-1,7-diol?
The InChIKey is GPYBPRYIQAVBEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O2/c1-10(12)6-5-7-3-2-4-8(11)9(7)10/h2-4,11-12H,5-6H2,1H3.
What are the key properties of 1-methyl-2,3-dihydroindene-1,7-diol?
1-methyl-2,3-dihydroindene-1,7-diol has a molecular weight of 164.20 g/mol, XLogP of 1.55, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2,3-dihydroindene-1,7-diol is sourced from PubChem (CID 175232410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).