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

C51H67O8PY4-4 — CID 160996329

IUPAC(1S)-3-phosphanyl-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]butan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;tetrakis(yttrium)
SMILESCCC[C@@H](O)[C@@H]1CCc2c[c-]ccc2O1.CCC[C@@H](O)[C@H]1CCc2c[c-]ccc2O1.CCC[C@H](O)[C@@H]1CCc2c[c-]ccc2O1.O[C@@H](CCP)[C@H]1CCc2c[c-]ccc2O1.[Y].[Y].[Y].[Y]
InChIInChI=1S/3C13H17O2.C12H16O2P.4Y/c3*1-2-5-11(14)13-9-8-10-6-3-4-7-12(10)15-13;13-10(7-8-15)12-6-5-9-3-1-2-4-11(9)14-12;;;;/h3*4,6-7,11,13-14H,2,5,8-9H2,1H3;2-4,10,12-13H,5-8,15H2;;;;/q4*-1;;;;/t11-,13+;2*11-,13-;10-,12+;;;;/m1100..../s1
InChIKeyIPBPILPLQFVSLP-RJZBZZMZSA-N
MW1194.69 g/mol
LogP8.82
Rot. Bonds12

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

(1S)-3-phosphanyl-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]butan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;tetrakis(yttrium) (PubChem CID 160996329) has the molecular formula C51H67O8PY4-4 and a molecular weight of 1194.69 g/mol. Its IUPAC name is (1S)-3-phosphanyl-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]butan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;tetrakis(yttrium).

Molecular Properties

Compound Name(1S)-3-phosphanyl-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]butan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;tetrakis(yttrium)
PubChem CID160996329
Molecular FormulaC51H67O8PY4-4
Molecular Weight1194.69 g/mol
Exact Mass1194.08
IUPAC Name(1S)-3-phosphanyl-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]butan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;tetrakis(yttrium)
SMILESCCC[C@@H](O)[C@@H]1CCc2c[c-]ccc2O1.CCC[C@@H](O)[C@H]1CCc2c[c-]ccc2O1.CCC[C@H](O)[C@@H]1CCc2c[c-]ccc2O1.O[C@@H](CCP)[C@H]1CCc2c[c-]ccc2O1.[Y].[Y].[Y].[Y]
InChIInChI=1S/3C13H17O2.C12H16O2P.4Y/c3*1-2-5-11(14)13-9-8-10-6-3-4-7-12(10)15-13;13-10(7-8-15)12-6-5-9-3-1-2-4-11(9)14-12;;;;/h3*4,6-7,11,13-14H,2,5,8-9H2,1H3;2-4,10,12-13H,5-8,15H2;;;;/q4*-1;;;;/t11-,13+;2*11-,13-;10-,12+;;;;/m1100..../s1
InChIKeyIPBPILPLQFVSLP-RJZBZZMZSA-N
XLogP8.82
TPSA117.84 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds12
Heavy Atoms64
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001194.69
LogP ≤ 58.82
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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

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Related Compounds

methane;(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;bis(yttrium)
CID 157161955
(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
methane;(1S)-3-phosphanyl-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]butan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;tetrakis(yttrium)
CID 159215350
(1S)-1-[(2R)-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;bis(yttrium)
CID 160745831

Frequently Asked Questions

What is the IUPAC name of (1S)-3-phosphanyl-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]butan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;tetrakis(yttrium)?
The IUPAC name of (1S)-3-phosphanyl-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]butan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;tetrakis(yttrium) (CID 160996329) is (1S)-3-phosphanyl-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]butan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;tetrakis(yttrium).
What is the SMILES notation for (1S)-3-phosphanyl-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]butan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;tetrakis(yttrium)?
The canonical SMILES for (1S)-3-phosphanyl-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]butan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;tetrakis(yttrium) is CCC[C@@H](O)[C@@H]1CCc2c[c-]ccc2O1.CCC[C@@H](O)[C@H]1CCc2c[c-]ccc2O1.CCC[C@H](O)[C@@H]1CCc2c[c-]ccc2O1.O[C@@H](CCP)[C@H]1CCc2c[c-]ccc2O1.[Y].[Y].[Y].[Y].
What is the InChIKey of (1S)-3-phosphanyl-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]butan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;tetrakis(yttrium)?
The InChIKey is IPBPILPLQFVSLP-RJZBZZMZSA-N. The full InChI is InChI=1S/3C13H17O2.C12H16O2P.4Y/c3*1-2-5-11(14)13-9-8-10-6-3-4-7-12(10)15-13;13-10(7-8-15)12-6-5-9-3-1-2-4-11(9)14-12;;;;/h3*4,6-7,11,13-14H,2,5,8-9H2,1H3;2-4,10,12-13H,5-8,15H2;;;;/q4*-1;;;;/t11-,13+;2*11-,13-;10-,12+;;;;/m1100..../s1.
What are the key properties of (1S)-3-phosphanyl-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]butan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;tetrakis(yttrium)?
(1S)-3-phosphanyl-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]butan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;tetrakis(yttrium) has a molecular weight of 1194.69 g/mol, XLogP of 8.82, 12 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-3-phosphanyl-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]butan-1-ol;(1R)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;(1S)-1-[(2S)-2,3,4,6-tetrahydrochromen-6-id-2-yl]butan-1-ol;tetrakis(yttrium) is sourced from PubChem (CID 160996329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).