[(2R,3R,4R)-6-iodo-2,3-bis[tri(propan-2-yl)silyloxy]-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane

C32H67IO4Si3 — CID 134879298

IUPAC[(2R,3R,4R)-6-iodo-2,3-bis[tri(propan-2-yl)silyloxy]-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane
SMILESCC(C)[Si](O[C@H]1OC(I)=C[C@@H](O[Si](C(C)C)(C(C)C)C(C)C)[C@H]1O[Si](C(C)C)(C(C)C)C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C32H67IO4Si3/c1-20(2)38(21(3)4,22(5)6)35-29-19-30(33)34-32(37-40(26(13)14,27(15)16)28(17)18)31(29)36-39(23(7)8,24(9)10)25(11)12/h19-29,31-32H,1-18H3/t29-,31-,32-/m1/s1
InChIKeyWWNMQRSSOBOZLV-AFEGNUHBSA-N
MW727.05 g/mol
LogP11.93
Rot. Bonds15

About [(2R,3R,4R)-6-iodo-2,3-bis[tri(propan-2-yl)silyloxy]-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane

[(2R,3R,4R)-6-iodo-2,3-bis[tri(propan-2-yl)silyloxy]-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane (PubChem CID 134879298) has the molecular formula C32H67IO4Si3 and a molecular weight of 727.05 g/mol. Its IUPAC name is [(2R,3R,4R)-6-iodo-2,3-bis[tri(propan-2-yl)silyloxy]-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane.

Molecular Properties

Compound Name[(2R,3R,4R)-6-iodo-2,3-bis[tri(propan-2-yl)silyloxy]-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane
PubChem CID134879298
Molecular FormulaC32H67IO4Si3
Molecular Weight727.05 g/mol
Exact Mass726.34
IUPAC Name[(2R,3R,4R)-6-iodo-2,3-bis[tri(propan-2-yl)silyloxy]-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane
SMILESCC(C)[Si](O[C@H]1OC(I)=C[C@@H](O[Si](C(C)C)(C(C)C)C(C)C)[C@H]1O[Si](C(C)C)(C(C)C)C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C32H67IO4Si3/c1-20(2)38(21(3)4,22(5)6)35-29-19-30(33)34-32(37-40(26(13)14,27(15)16)28(17)18)31(29)36-39(23(7)8,24(9)10)25(11)12/h19-29,31-32H,1-18H3/t29-,31-,32-/m1/s1
InChIKeyWWNMQRSSOBOZLV-AFEGNUHBSA-N
XLogP11.93
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds15
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500727.05
LogP ≤ 511.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

(((2R,3R,4R)-6-iodo-2-(((Triisopropylsilyl)oxy)methyl)-3,4-dihydro-2H-pyran-3,4-diyl)bis(oxy))bis(triisopropylsilane)
CID 11787507
[(2R,3R,4R)-2,3-bis[[tert-butyl(dimethyl)silyl]oxy]-6-tributylstannyl-3,4-dihydro-2H-pyran-4-yl]oxy-tert-butyl-dimethylsilane
CID 134879222
[(2R,3R,4R)-6-iodo-2-methyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane
CID 101227355

Frequently Asked Questions

What is the IUPAC name of [(2R,3R,4R)-6-iodo-2,3-bis[tri(propan-2-yl)silyloxy]-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane?
The IUPAC name of [(2R,3R,4R)-6-iodo-2,3-bis[tri(propan-2-yl)silyloxy]-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane (CID 134879298) is [(2R,3R,4R)-6-iodo-2,3-bis[tri(propan-2-yl)silyloxy]-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane.
What is the SMILES notation for [(2R,3R,4R)-6-iodo-2,3-bis[tri(propan-2-yl)silyloxy]-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane?
The canonical SMILES for [(2R,3R,4R)-6-iodo-2,3-bis[tri(propan-2-yl)silyloxy]-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane is CC(C)[Si](O[C@H]1OC(I)=C[C@@H](O[Si](C(C)C)(C(C)C)C(C)C)[C@H]1O[Si](C(C)C)(C(C)C)C(C)C)(C(C)C)C(C)C.
What is the InChIKey of [(2R,3R,4R)-6-iodo-2,3-bis[tri(propan-2-yl)silyloxy]-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane?
The InChIKey is WWNMQRSSOBOZLV-AFEGNUHBSA-N. The full InChI is InChI=1S/C32H67IO4Si3/c1-20(2)38(21(3)4,22(5)6)35-29-19-30(33)34-32(37-40(26(13)14,27(15)16)28(17)18)31(29)36-39(23(7)8,24(9)10)25(11)12/h19-29,31-32H,1-18H3/t29-,31-,32-/m1/s1.
What are the key properties of [(2R,3R,4R)-6-iodo-2,3-bis[tri(propan-2-yl)silyloxy]-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane?
[(2R,3R,4R)-6-iodo-2,3-bis[tri(propan-2-yl)silyloxy]-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane has a molecular weight of 727.05 g/mol, XLogP of 11.93, 15 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,3R,4R)-6-iodo-2,3-bis[tri(propan-2-yl)silyloxy]-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane is sourced from PubChem (CID 134879298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).