[4-[dimethyl(1-trimethylsilyloxyethyl)silyl]oxy-4-methylhexan-3-yl]-[(2R)-2-ethyl-3-(4-ethyl-2-methyl-4-trimethylsilyloxasiletan-2-yl)pentan-2-yl]oxy-methyl-propylsilane

C33H76O4Si5 — CID 90321169

IUPAC[4-[dimethyl(1-trimethylsilyloxyethyl)silyl]oxy-4-methylhexan-3-yl]-[(2R)-2-ethyl-3-(4-ethyl-2-methyl-4-trimethylsilyloxasiletan-2-yl)pentan-2-yl]oxy-methyl-propylsilane
SMILESCCC[Si](C)(O[C@](C)(CC)C(CC)[Si]1(C)CC(CC)([Si](C)(C)C)O1)C(CC)C(C)(CC)O[Si](C)(C)C(C)O[Si](C)(C)C
InChIInChI=1S/C33H76O4Si5/c1-20-26-41(18,29(21-2)31(8,23-4)35-40(16,17)28(7)34-39(13,14)15)36-32(9,24-5)30(22-3)42(19)27-33(25-6,37-42)38(10,11)12/h28-30H,20-27H2,1-19H3/t28?,29?,30?,31?,32-,33?,41?,42?/m1/s1
InChIKeyOZJWTOVJGTWKGP-MLFMNRBTSA-N
MW677.40 g/mol
LogP11.52
Rot. Bonds19

About [4-[dimethyl(1-trimethylsilyloxyethyl)silyl]oxy-4-methylhexan-3-yl]-[(2R)-2-ethyl-3-(4-ethyl-2-methyl-4-trimethylsilyloxasiletan-2-yl)pentan-2-yl]oxy-methyl-propylsilane

[4-[dimethyl(1-trimethylsilyloxyethyl)silyl]oxy-4-methylhexan-3-yl]-[(2R)-2-ethyl-3-(4-ethyl-2-methyl-4-trimethylsilyloxasiletan-2-yl)pentan-2-yl]oxy-methyl-propylsilane (PubChem CID 90321169) has the molecular formula C33H76O4Si5 and a molecular weight of 677.40 g/mol. Its IUPAC name is [4-[dimethyl(1-trimethylsilyloxyethyl)silyl]oxy-4-methylhexan-3-yl]-[(2R)-2-ethyl-3-(4-ethyl-2-methyl-4-trimethylsilyloxasiletan-2-yl)pentan-2-yl]oxy-methyl-propylsilane.

Molecular Properties

Compound Name[4-[dimethyl(1-trimethylsilyloxyethyl)silyl]oxy-4-methylhexan-3-yl]-[(2R)-2-ethyl-3-(4-ethyl-2-methyl-4-trimethylsilyloxasiletan-2-yl)pentan-2-yl]oxy-methyl-propylsilane
PubChem CID90321169
Molecular FormulaC33H76O4Si5
Molecular Weight677.40 g/mol
Exact Mass676.46
IUPAC Name[4-[dimethyl(1-trimethylsilyloxyethyl)silyl]oxy-4-methylhexan-3-yl]-[(2R)-2-ethyl-3-(4-ethyl-2-methyl-4-trimethylsilyloxasiletan-2-yl)pentan-2-yl]oxy-methyl-propylsilane
SMILESCCC[Si](C)(O[C@](C)(CC)C(CC)[Si]1(C)CC(CC)([Si](C)(C)C)O1)C(CC)C(C)(CC)O[Si](C)(C)C(C)O[Si](C)(C)C
InChIInChI=1S/C33H76O4Si5/c1-20-26-41(18,29(21-2)31(8,23-4)35-40(16,17)28(7)34-39(13,14)15)36-32(9,24-5)30(22-3)42(19)27-33(25-6,37-42)38(10,11)12/h28-30H,20-27H2,1-19H3/t28?,29?,30?,31?,32-,33?,41?,42?/m1/s1
InChIKeyOZJWTOVJGTWKGP-MLFMNRBTSA-N
XLogP11.52
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds19
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500677.40
LogP ≤ 511.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

CID 89552887
CID 89552887
CID 89552924
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CID 89741885
CID 89741885
CID 89762748
CID 89762748
CID 89839383
CID 89839383
CID 89981036
CID 89981036
CID 90140963
CID 90140963
CID 90208256
CID 90208256
CID 90221577
CID 90221577
CID 90772696
CID 90772696
CID 123578331
CID 123578331
CID 123594678
CID 123594678

Frequently Asked Questions

What is the IUPAC name of [4-[dimethyl(1-trimethylsilyloxyethyl)silyl]oxy-4-methylhexan-3-yl]-[(2R)-2-ethyl-3-(4-ethyl-2-methyl-4-trimethylsilyloxasiletan-2-yl)pentan-2-yl]oxy-methyl-propylsilane?
The IUPAC name of [4-[dimethyl(1-trimethylsilyloxyethyl)silyl]oxy-4-methylhexan-3-yl]-[(2R)-2-ethyl-3-(4-ethyl-2-methyl-4-trimethylsilyloxasiletan-2-yl)pentan-2-yl]oxy-methyl-propylsilane (CID 90321169) is [4-[dimethyl(1-trimethylsilyloxyethyl)silyl]oxy-4-methylhexan-3-yl]-[(2R)-2-ethyl-3-(4-ethyl-2-methyl-4-trimethylsilyloxasiletan-2-yl)pentan-2-yl]oxy-methyl-propylsilane.
What is the SMILES notation for [4-[dimethyl(1-trimethylsilyloxyethyl)silyl]oxy-4-methylhexan-3-yl]-[(2R)-2-ethyl-3-(4-ethyl-2-methyl-4-trimethylsilyloxasiletan-2-yl)pentan-2-yl]oxy-methyl-propylsilane?
The canonical SMILES for [4-[dimethyl(1-trimethylsilyloxyethyl)silyl]oxy-4-methylhexan-3-yl]-[(2R)-2-ethyl-3-(4-ethyl-2-methyl-4-trimethylsilyloxasiletan-2-yl)pentan-2-yl]oxy-methyl-propylsilane is CCC[Si](C)(O[C@](C)(CC)C(CC)[Si]1(C)CC(CC)([Si](C)(C)C)O1)C(CC)C(C)(CC)O[Si](C)(C)C(C)O[Si](C)(C)C.
What is the InChIKey of [4-[dimethyl(1-trimethylsilyloxyethyl)silyl]oxy-4-methylhexan-3-yl]-[(2R)-2-ethyl-3-(4-ethyl-2-methyl-4-trimethylsilyloxasiletan-2-yl)pentan-2-yl]oxy-methyl-propylsilane?
The InChIKey is OZJWTOVJGTWKGP-MLFMNRBTSA-N. The full InChI is InChI=1S/C33H76O4Si5/c1-20-26-41(18,29(21-2)31(8,23-4)35-40(16,17)28(7)34-39(13,14)15)36-32(9,24-5)30(22-3)42(19)27-33(25-6,37-42)38(10,11)12/h28-30H,20-27H2,1-19H3/t28?,29?,30?,31?,32-,33?,41?,42?/m1/s1.
What are the key properties of [4-[dimethyl(1-trimethylsilyloxyethyl)silyl]oxy-4-methylhexan-3-yl]-[(2R)-2-ethyl-3-(4-ethyl-2-methyl-4-trimethylsilyloxasiletan-2-yl)pentan-2-yl]oxy-methyl-propylsilane?
[4-[dimethyl(1-trimethylsilyloxyethyl)silyl]oxy-4-methylhexan-3-yl]-[(2R)-2-ethyl-3-(4-ethyl-2-methyl-4-trimethylsilyloxasiletan-2-yl)pentan-2-yl]oxy-methyl-propylsilane has a molecular weight of 677.40 g/mol, XLogP of 11.52, 19 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[dimethyl(1-trimethylsilyloxyethyl)silyl]oxy-4-methylhexan-3-yl]-[(2R)-2-ethyl-3-(4-ethyl-2-methyl-4-trimethylsilyloxasiletan-2-yl)pentan-2-yl]oxy-methyl-propylsilane is sourced from PubChem (CID 90321169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).