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)

C52H71O8PY4-4 — CID 159215350

IUPACmethane;(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)
SMILESC.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]
InChIInChI=1S/3C13H17O2.C12H16O2P.CH4.4Y/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;1H4;;;;/q4*-1;;;;;/t11-,13+;2*11-,13-;10-,12+;;;;;/m1100...../s1
InChIKeyDDYGKUDJWCHVSH-NXSHLOPFSA-N
MW1210.73 g/mol
LogP9.46
Rot. Bonds12

About 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)

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) (PubChem CID 159215350) has the molecular formula C52H71O8PY4-4 and a molecular weight of 1210.73 g/mol. Its IUPAC name is 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).

Molecular Properties

Compound Namemethane;(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 CID159215350
Molecular FormulaC52H71O8PY4-4
Molecular Weight1210.73 g/mol
Exact Mass1210.11
IUPAC Namemethane;(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)
SMILESC.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]
InChIInChI=1S/3C13H17O2.C12H16O2P.CH4.4Y/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;1H4;;;;/q4*-1;;;;;/t11-,13+;2*11-,13-;10-,12+;;;;;/m1100...../s1
InChIKeyDDYGKUDJWCHVSH-NXSHLOPFSA-N
XLogP9.46
TPSA117.84 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds12
Heavy Atoms65
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001210.73
LogP ≤ 59.46
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 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) 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
(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
(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

Frequently Asked Questions

What is the IUPAC name of 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)?
The IUPAC name of 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) is 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).
What is the SMILES notation for 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)?
The canonical SMILES for 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) is C.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 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)?
The InChIKey is DDYGKUDJWCHVSH-NXSHLOPFSA-N. The full InChI is InChI=1S/3C13H17O2.C12H16O2P.CH4.4Y/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;1H4;;;;/q4*-1;;;;;/t11-,13+;2*11-,13-;10-,12+;;;;;/m1100...../s1.
What are the key properties of 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)?
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) has a molecular weight of 1210.73 g/mol, XLogP of 9.46, 12 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 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) is sourced from PubChem (CID 159215350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).