(1S)-7-(methoxymethoxy)-2,3-dihydro-1H-inden-1-ol

C11H14O3 — CID 130651927

IUPAC(1S)-7-(methoxymethoxy)-2,3-dihydro-1H-inden-1-ol
SMILESCOCOc1cccc2c1[C@@H](O)CC2
InChIInChI=1S/C11H14O3/c1-13-7-14-10-4-2-3-8-5-6-9(12)11(8)10/h2-4,9,12H,5-7H2,1H3/t9-/m0/s1
InChIKeyBPNXXGPEJQIVQU-VIFPVBQESA-N
MW194.23 g/mol
LogP1.65
Rot. Bonds3

About (1S)-7-(methoxymethoxy)-2,3-dihydro-1H-inden-1-ol

(1S)-7-(methoxymethoxy)-2,3-dihydro-1H-inden-1-ol (PubChem CID 130651927) has the molecular formula C11H14O3 and a molecular weight of 194.23 g/mol. Its IUPAC name is (1S)-7-(methoxymethoxy)-2,3-dihydro-1H-inden-1-ol.

Molecular Properties

Compound Name(1S)-7-(methoxymethoxy)-2,3-dihydro-1H-inden-1-ol
PubChem CID130651927
Molecular FormulaC11H14O3
Molecular Weight194.23 g/mol
Exact Mass194.09
IUPAC Name(1S)-7-(methoxymethoxy)-2,3-dihydro-1H-inden-1-ol
SMILESCOCOc1cccc2c1[C@@H](O)CC2
InChIInChI=1S/C11H14O3/c1-13-7-14-10-4-2-3-8-5-6-9(12)11(8)10/h2-4,9,12H,5-7H2,1H3/t9-/m0/s1
InChIKeyBPNXXGPEJQIVQU-VIFPVBQESA-N
XLogP1.65
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

7-propoxy-2,3-dihydro-1H-inden-1-ol
CID 126991757
(1R)-7-prop-2-ynoxy-2,3-dihydro-1H-inden-1-ol
CID 130631314
(3-hydroxy-2,3-dihydro-1H-inden-4-yl) acetate
CID 19864735
2-(methoxymethoxy)-1,1a,6,6a-tetrahydrocyclopropa[a]indene
CID 57457859
7-(hydroxymethyl)-2,3-dihydro-1H-inden-1-ol
CID 15329434
8-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-ol
CID 112709110
8-(methoxymethoxy)-3,4-dihydro-1H-naphthalen-2-one
CID 158378685
trans-(1R,2S)-2-[2-(methoxymethoxy)phenyl]cyclohexan-1-ol
CID 54125386
(1S)-7-bromo-2,3-dihydro-1H-inden-1-ol
CID 129246818
2-fluoro-3-(methoxymethoxy)phenol
CID 125115962
ethyl 3-hydroxy-2,3-dihydro-1H-indene-4-carboxylate
CID 23591011
(5R,6R)-6-[2-(methoxymethoxy)phenyl]-2-methyl-5-prop-1-en-2-ylcyclohexen-1-ol
CID 10356773

Frequently Asked Questions

What is the IUPAC name of (1S)-7-(methoxymethoxy)-2,3-dihydro-1H-inden-1-ol?
The IUPAC name of (1S)-7-(methoxymethoxy)-2,3-dihydro-1H-inden-1-ol (CID 130651927) is (1S)-7-(methoxymethoxy)-2,3-dihydro-1H-inden-1-ol.
What is the SMILES notation for (1S)-7-(methoxymethoxy)-2,3-dihydro-1H-inden-1-ol?
The canonical SMILES for (1S)-7-(methoxymethoxy)-2,3-dihydro-1H-inden-1-ol is COCOc1cccc2c1[C@@H](O)CC2.
What is the InChIKey of (1S)-7-(methoxymethoxy)-2,3-dihydro-1H-inden-1-ol?
The InChIKey is BPNXXGPEJQIVQU-VIFPVBQESA-N. The full InChI is InChI=1S/C11H14O3/c1-13-7-14-10-4-2-3-8-5-6-9(12)11(8)10/h2-4,9,12H,5-7H2,1H3/t9-/m0/s1.
What are the key properties of (1S)-7-(methoxymethoxy)-2,3-dihydro-1H-inden-1-ol?
(1S)-7-(methoxymethoxy)-2,3-dihydro-1H-inden-1-ol has a molecular weight of 194.23 g/mol, XLogP of 1.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-7-(methoxymethoxy)-2,3-dihydro-1H-inden-1-ol is sourced from PubChem (CID 130651927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).