7-propoxy-2,3-dihydro-1H-inden-1-ol

C12H16O2 — CID 126991757

IUPAC7-propoxy-2,3-dihydro-1H-inden-1-ol
SMILESCCCOc1cccc2c1C(O)CC2
InChIInChI=1S/C12H16O2/c1-2-8-14-11-5-3-4-9-6-7-10(13)12(9)11/h3-5,10,13H,2,6-8H2,1H3
InChIKeyKZZYZYPSCAOQTD-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.45
Rot. Bonds3

About 7-propoxy-2,3-dihydro-1H-inden-1-ol

7-propoxy-2,3-dihydro-1H-inden-1-ol (PubChem CID 126991757) has the molecular formula C12H16O2 and a molecular weight of 192.26 g/mol. Its IUPAC name is 7-propoxy-2,3-dihydro-1H-inden-1-ol.

Molecular Properties

Compound Name7-propoxy-2,3-dihydro-1H-inden-1-ol
PubChem CID126991757
Molecular FormulaC12H16O2
Molecular Weight192.26 g/mol
Exact Mass192.12
IUPAC Name7-propoxy-2,3-dihydro-1H-inden-1-ol
SMILESCCCOc1cccc2c1C(O)CC2
InChIInChI=1S/C12H16O2/c1-2-8-14-11-5-3-4-9-6-7-10(13)12(9)11/h3-5,10,13H,2,6-8H2,1H3
InChIKeyKZZYZYPSCAOQTD-UHFFFAOYSA-N
XLogP2.45
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-7-(methoxymethoxy)-2,3-dihydro-1H-inden-1-ol
CID 130651927
(1R)-7-prop-2-ynoxy-2,3-dihydro-1H-inden-1-ol
CID 130631314
7-propoxy-2,3-dihydro-1H-indene-1-carbaldehyde
CID 87884769
(3-hydroxy-2,3-dihydro-1H-inden-4-yl) acetate
CID 19864735
(1R)-N-[(1R)-1-phenylethyl]-7-propoxy-2,3-dihydro-1H-inden-1-amine
CID 10732655
2-[[(3S)-3-amino-2,3-dihydro-1H-inden-4-yl]oxy]ethanol
CID 130673894
2-phenyl-3-propoxyphenol
CID 155695054
ethyl 3-hydroxy-2,3-dihydro-1H-indene-4-carboxylate
CID 23591011
7-(hydroxymethyl)-2,3-dihydro-1H-inden-1-ol
CID 15329434
3-hydroxy-7-propoxy-2,3-dihydro-1H-indene-4-sulfinate
CID 122544445
8-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-ol
CID 112709110
(1S)-7-bromo-2,3-dihydro-1H-inden-1-ol
CID 129246818

Frequently Asked Questions

What is the IUPAC name of 7-propoxy-2,3-dihydro-1H-inden-1-ol?
The IUPAC name of 7-propoxy-2,3-dihydro-1H-inden-1-ol (CID 126991757) is 7-propoxy-2,3-dihydro-1H-inden-1-ol.
What is the SMILES notation for 7-propoxy-2,3-dihydro-1H-inden-1-ol?
The canonical SMILES for 7-propoxy-2,3-dihydro-1H-inden-1-ol is CCCOc1cccc2c1C(O)CC2.
What is the InChIKey of 7-propoxy-2,3-dihydro-1H-inden-1-ol?
The InChIKey is KZZYZYPSCAOQTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O2/c1-2-8-14-11-5-3-4-9-6-7-10(13)12(9)11/h3-5,10,13H,2,6-8H2,1H3.
What are the key properties of 7-propoxy-2,3-dihydro-1H-inden-1-ol?
7-propoxy-2,3-dihydro-1H-inden-1-ol has a molecular weight of 192.26 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-propoxy-2,3-dihydro-1H-inden-1-ol is sourced from PubChem (CID 126991757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).