[2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-[[5-[2-[[5-[[5-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-4-methyl-5-pent-4-enoxyoxolan-3-yl]oxy-4-methyl-3-phosphanyloxyoxolan-2-yl]methoxy]-4-methyloxolan-3-yl]oxyphosphane

C67H100O16P4Si2 — CID 59345744

IUPAC[2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-[[5-[2-[[5-[[5-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-4-methyl-5-pent-4-enoxyoxolan-3-yl]oxy-4-methyl-3-phosphanyloxyoxolan-2-yl]methoxy]-4-methyloxolan-3-yl]oxyphosphane
SMILESC=CCCCOC1OC(COC2OC(COC3OC(CO[Si](c4ccccc4)(c4ccccc4)C(C)(C)C)C(OP)C3C)C(OP)C2C)C(OC2OC(COC3OC(CO[Si](c4ccccc4)(c4ccccc4)C(C)(C)C)C(OP)C3C)C(OP)C2C)C1C
InChIInChI=1S/C67H100O16P4Si2/c1-13-14-27-36-68-61-42(2)56(79-65-46(6)60(83-87)53(78-65)39-71-64-45(5)59(82-86)55(77-64)41-73-89(67(10,11)12,49-32-23-17-24-33-49)50-34-25-18-26-35-50)51(74-61)37-69-62-43(3)57(80-84)52(75-62)38-70-63-44(4)58(81-85)54(76-63)40-72-88(66(7,8)9,47-28-19-15-20-29-47)48-30-21-16-22-31-48/h13,15-26,28-35,42-46,51-65H,1,14,27,36-41,84-87H2,2-12H3
InChIKeyNXAKODHWQZFZNM-UHFFFAOYSA-N
MW1341.59 g/mol
LogP10.06
Rot. Bonds30

About [2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-[[5-[2-[[5-[[5-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-4-methyl-5-pent-4-enoxyoxolan-3-yl]oxy-4-methyl-3-phosphanyloxyoxolan-2-yl]methoxy]-4-methyloxolan-3-yl]oxyphosphane

[2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-[[5-[2-[[5-[[5-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-4-methyl-5-pent-4-enoxyoxolan-3-yl]oxy-4-methyl-3-phosphanyloxyoxolan-2-yl]methoxy]-4-methyloxolan-3-yl]oxyphosphane (PubChem CID 59345744) has the molecular formula C67H100O16P4Si2 and a molecular weight of 1341.59 g/mol. Its IUPAC name is [2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-[[5-[2-[[5-[[5-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-4-methyl-5-pent-4-enoxyoxolan-3-yl]oxy-4-methyl-3-phosphanyloxyoxolan-2-yl]methoxy]-4-methyloxolan-3-yl]oxyphosphane.

Molecular Properties

Compound Name[2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-[[5-[2-[[5-[[5-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-4-methyl-5-pent-4-enoxyoxolan-3-yl]oxy-4-methyl-3-phosphanyloxyoxolan-2-yl]methoxy]-4-methyloxolan-3-yl]oxyphosphane
PubChem CID59345744
Molecular FormulaC67H100O16P4Si2
Molecular Weight1341.59 g/mol
Exact Mass1340.55
IUPAC Name[2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-[[5-[2-[[5-[[5-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-4-methyl-5-pent-4-enoxyoxolan-3-yl]oxy-4-methyl-3-phosphanyloxyoxolan-2-yl]methoxy]-4-methyloxolan-3-yl]oxyphosphane
SMILESC=CCCCOC1OC(COC2OC(COC3OC(CO[Si](c4ccccc4)(c4ccccc4)C(C)(C)C)C(OP)C3C)C(OP)C2C)C(OC2OC(COC3OC(CO[Si](c4ccccc4)(c4ccccc4)C(C)(C)C)C(OP)C3C)C(OP)C2C)C1C
InChIInChI=1S/C67H100O16P4Si2/c1-13-14-27-36-68-61-42(2)56(79-65-46(6)60(83-87)53(78-65)39-71-64-45(5)59(82-86)55(77-64)41-73-89(67(10,11)12,49-32-23-17-24-33-49)50-34-25-18-26-35-50)51(74-61)37-69-62-43(3)57(80-84)52(75-62)38-70-63-44(4)58(81-85)54(76-63)40-72-88(66(7,8)9,47-28-19-15-20-29-47)48-30-21-16-22-31-48/h13,15-26,28-35,42-46,51-65H,1,14,27,36-41,84-87H2,2-12H3
InChIKeyNXAKODHWQZFZNM-UHFFFAOYSA-N
XLogP10.06
TPSA147.68 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds30
Heavy Atoms89
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001341.59
LogP ≤ 510.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-[[5-[2-[[5-[[5-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-4-methyl-5-pent-4-enoxyoxolan-3-yl]oxy-4-methyl-3-phosphanyloxyoxolan-2-yl]methoxy]-4-methyloxolan-3-yl]oxyphosphane?
The IUPAC name of [2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-[[5-[2-[[5-[[5-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-4-methyl-5-pent-4-enoxyoxolan-3-yl]oxy-4-methyl-3-phosphanyloxyoxolan-2-yl]methoxy]-4-methyloxolan-3-yl]oxyphosphane (CID 59345744) is [2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-[[5-[2-[[5-[[5-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-4-methyl-5-pent-4-enoxyoxolan-3-yl]oxy-4-methyl-3-phosphanyloxyoxolan-2-yl]methoxy]-4-methyloxolan-3-yl]oxyphosphane.
What is the SMILES notation for [2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-[[5-[2-[[5-[[5-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-4-methyl-5-pent-4-enoxyoxolan-3-yl]oxy-4-methyl-3-phosphanyloxyoxolan-2-yl]methoxy]-4-methyloxolan-3-yl]oxyphosphane?
The canonical SMILES for [2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-[[5-[2-[[5-[[5-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-4-methyl-5-pent-4-enoxyoxolan-3-yl]oxy-4-methyl-3-phosphanyloxyoxolan-2-yl]methoxy]-4-methyloxolan-3-yl]oxyphosphane is C=CCCCOC1OC(COC2OC(COC3OC(CO[Si](c4ccccc4)(c4ccccc4)C(C)(C)C)C(OP)C3C)C(OP)C2C)C(OC2OC(COC3OC(CO[Si](c4ccccc4)(c4ccccc4)C(C)(C)C)C(OP)C3C)C(OP)C2C)C1C.
What is the InChIKey of [2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-[[5-[2-[[5-[[5-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-4-methyl-5-pent-4-enoxyoxolan-3-yl]oxy-4-methyl-3-phosphanyloxyoxolan-2-yl]methoxy]-4-methyloxolan-3-yl]oxyphosphane?
The InChIKey is NXAKODHWQZFZNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C67H100O16P4Si2/c1-13-14-27-36-68-61-42(2)56(79-65-46(6)60(83-87)53(78-65)39-71-64-45(5)59(82-86)55(77-64)41-73-89(67(10,11)12,49-32-23-17-24-33-49)50-34-25-18-26-35-50)51(74-61)37-69-62-43(3)57(80-84)52(75-62)38-70-63-44(4)58(81-85)54(76-63)40-72-88(66(7,8)9,47-28-19-15-20-29-47)48-30-21-16-22-31-48/h13,15-26,28-35,42-46,51-65H,1,14,27,36-41,84-87H2,2-12H3.
What are the key properties of [2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-[[5-[2-[[5-[[5-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-4-methyl-5-pent-4-enoxyoxolan-3-yl]oxy-4-methyl-3-phosphanyloxyoxolan-2-yl]methoxy]-4-methyloxolan-3-yl]oxyphosphane?
[2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-[[5-[2-[[5-[[5-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-4-methyl-5-pent-4-enoxyoxolan-3-yl]oxy-4-methyl-3-phosphanyloxyoxolan-2-yl]methoxy]-4-methyloxolan-3-yl]oxyphosphane has a molecular weight of 1341.59 g/mol, XLogP of 10.06, 30 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-[[5-[2-[[5-[[5-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-3-methyl-4-phosphanyloxyoxolan-2-yl]oxymethyl]-4-methyl-5-pent-4-enoxyoxolan-3-yl]oxy-4-methyl-3-phosphanyloxyoxolan-2-yl]methoxy]-4-methyloxolan-3-yl]oxyphosphane is sourced from PubChem (CID 59345744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).