(1S)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;tetrakis(yttrium)

C48H60O8Y4-4 — CID 159164751

IUPAC(1S)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;tetrakis(yttrium)
SMILESCC[C@@H](O)[C@@H]1CCc2c[c-]ccc2O1.CC[C@@H](O)[C@H]1CCc2c[c-]ccc2O1.CC[C@H](O)[C@@H]1CCc2c[c-]ccc2O1.CC[C@H](O)[C@H]1CCc2c[c-]ccc2O1.[Y].[Y].[Y].[Y]
InChIInChI=1S/4C12H15O2.4Y/c4*1-2-10(13)12-8-7-9-5-3-4-6-11(9)14-12;;;;/h4*4-6,10,12-13H,2,7-8H2,1H3;;;;/q4*-1;;;;/t2*10-,12+;2*10-,12-;;;;/m1010..../s1
InChIKeyVVAOGTWMADKZIY-HEFYQXDDSA-N
MW1120.62 g/mol
LogP7.80
Rot. Bonds8

About (1S)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;tetrakis(yttrium)

(1S)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;tetrakis(yttrium) (PubChem CID 159164751) has the molecular formula C48H60O8Y4-4 and a molecular weight of 1120.62 g/mol. Its IUPAC name is (1S)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;tetrakis(yttrium).

Molecular Properties

Compound Name(1S)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;tetrakis(yttrium)
PubChem CID159164751
Molecular FormulaC48H60O8Y4-4
Molecular Weight1120.62 g/mol
Exact Mass1120.05
IUPAC Name(1S)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;tetrakis(yttrium)
SMILESCC[C@@H](O)[C@@H]1CCc2c[c-]ccc2O1.CC[C@@H](O)[C@H]1CCc2c[c-]ccc2O1.CC[C@H](O)[C@@H]1CCc2c[c-]ccc2O1.CC[C@H](O)[C@H]1CCc2c[c-]ccc2O1.[Y].[Y].[Y].[Y]
InChIInChI=1S/4C12H15O2.4Y/c4*1-2-10(13)12-8-7-9-5-3-4-6-11(9)14-12;;;;/h4*4-6,10,12-13H,2,7-8H2,1H3;;;;/q4*-1;;;;/t2*10-,12+;2*10-,12-;;;;/m1010..../s1
InChIKeyVVAOGTWMADKZIY-HEFYQXDDSA-N
XLogP7.80
TPSA117.84 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms60
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001120.62
LogP ≤ 57.80
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze (1S)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;tetrakis(yttrium) with MolForge

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Frequently Asked Questions

What is the IUPAC name of (1S)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;tetrakis(yttrium)?
The IUPAC name of (1S)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;tetrakis(yttrium) (CID 159164751) is (1S)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;tetrakis(yttrium).
What is the SMILES notation for (1S)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;tetrakis(yttrium)?
The canonical SMILES for (1S)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;tetrakis(yttrium) is CC[C@@H](O)[C@@H]1CCc2c[c-]ccc2O1.CC[C@@H](O)[C@H]1CCc2c[c-]ccc2O1.CC[C@H](O)[C@@H]1CCc2c[c-]ccc2O1.CC[C@H](O)[C@H]1CCc2c[c-]ccc2O1.[Y].[Y].[Y].[Y].
What is the InChIKey of (1S)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;tetrakis(yttrium)?
The InChIKey is VVAOGTWMADKZIY-HEFYQXDDSA-N. The full InChI is InChI=1S/4C12H15O2.4Y/c4*1-2-10(13)12-8-7-9-5-3-4-6-11(9)14-12;;;;/h4*4-6,10,12-13H,2,7-8H2,1H3;;;;/q4*-1;;;;/t2*10-,12+;2*10-,12-;;;;/m1010..../s1.
What are the key properties of (1S)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;tetrakis(yttrium)?
(1S)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;tetrakis(yttrium) has a molecular weight of 1120.62 g/mol, XLogP of 7.80, 8 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2R)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]propan-1-ol;tetrakis(yttrium) is sourced from PubChem (CID 159164751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).