tert-butyl-[(2R,3R,4R)-2,4-dimethyl-1-tri(propan-2-yl)silyloxyhex-5-en-3-yl]oxy-dimethylsilane

C23H50O2Si2 — CID 10525893

IUPACtert-butyl-[(2R,3R,4R)-2,4-dimethyl-1-tri(propan-2-yl)silyloxyhex-5-en-3-yl]oxy-dimethylsilane
SMILESC=C[C@@H](C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](C)CO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C23H50O2Si2/c1-15-20(8)22(25-26(13,14)23(10,11)12)21(9)16-24-27(17(2)3,18(4)5)19(6)7/h15,17-22H,1,16H2,2-14H3/t20-,21-,22-/m1/s1
InChIKeyFBXXPZXLBWFVJJ-YPAWHYETSA-N
MW414.82 g/mol
LogP8.03
Rot. Bonds11

About tert-butyl-[(2R,3R,4R)-2,4-dimethyl-1-tri(propan-2-yl)silyloxyhex-5-en-3-yl]oxy-dimethylsilane

tert-butyl-[(2R,3R,4R)-2,4-dimethyl-1-tri(propan-2-yl)silyloxyhex-5-en-3-yl]oxy-dimethylsilane (PubChem CID 10525893) has the molecular formula C23H50O2Si2 and a molecular weight of 414.82 g/mol. Its IUPAC name is tert-butyl-[(2R,3R,4R)-2,4-dimethyl-1-tri(propan-2-yl)silyloxyhex-5-en-3-yl]oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(2R,3R,4R)-2,4-dimethyl-1-tri(propan-2-yl)silyloxyhex-5-en-3-yl]oxy-dimethylsilane
PubChem CID10525893
Molecular FormulaC23H50O2Si2
Molecular Weight414.82 g/mol
Exact Mass414.33
IUPAC Nametert-butyl-[(2R,3R,4R)-2,4-dimethyl-1-tri(propan-2-yl)silyloxyhex-5-en-3-yl]oxy-dimethylsilane
SMILESC=C[C@@H](C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](C)CO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C23H50O2Si2/c1-15-20(8)22(25-26(13,14)23(10,11)12)21(9)16-24-27(17(2)3,18(4)5)19(6)7/h15,17-22H,1,16H2,2-14H3/t20-,21-,22-/m1/s1
InChIKeyFBXXPZXLBWFVJJ-YPAWHYETSA-N
XLogP8.03
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500414.82
LogP ≤ 58.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze tert-butyl-[(2R,3R,4R)-2,4-dimethyl-1-tri(propan-2-yl)silyloxyhex-5-en-3-yl]oxy-dimethylsilane with MolForge

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Launch Full Analysis

Related Compounds

tert-butyl-[(2R)-2-[tert-butyl(dimethyl)silyl]oxypent-4-enoxy]-dimethylsilane
CID 11336491
(3S,4R)-1-[tert-butyl(dimethyl)silyl]oxy-4-methylhex-5-en-3-ol
CID 10999289
(2R,4R,5R)-2,4-bis(tert-Butyldimethylsilyloxy)-5-methylhept-6-ene
CID 24756074
tert-butyl-[(3S)-3-[tert-butyl(dimethyl)silyl]oxypent-4-enoxy]-dimethylsilane
CID 135034833
tert-butyl-[(3S,5S,6S)-5-methoxy-2,6-dimethyloct-7-en-3-yl]oxy-dimethylsilane
CID 151528866
Silane, dimethyl(pent-4-en-2-yloxy)isohexyloxy-
CID 91698385
Silane, dimethyl(dimethyl(but-3-enyloxy)silyloxy)isohexyloxy-
CID 91736917
(3S,4R)-3-[tert-butyl(dimethyl)silyl]oxy-4-methylhex-5-en-1-ol
CID 10800361
(2S,3S,4R)-1-[tert-butyl(dimethyl)silyl]oxy-2,4-dimethylhex-5-en-3-ol
CID 10868990
(2S,3R,4S)-1-[tert-butyl(dimethyl)silyl]oxy-2,4-dimethylhex-5-en-3-ol
CID 10967188
(2R,3R)-1-[tert-butyl(dimethyl)silyl]oxy-2-methylhex-5-en-3-ol
CID 11276618
tert-butyl-[(3S,4R)-3-[tert-butyl(dimethyl)silyl]oxy-4-methylhex-5-enoxy]-dimethylsilane
CID 11417041

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(2R,3R,4R)-2,4-dimethyl-1-tri(propan-2-yl)silyloxyhex-5-en-3-yl]oxy-dimethylsilane?
The IUPAC name of tert-butyl-[(2R,3R,4R)-2,4-dimethyl-1-tri(propan-2-yl)silyloxyhex-5-en-3-yl]oxy-dimethylsilane (CID 10525893) is tert-butyl-[(2R,3R,4R)-2,4-dimethyl-1-tri(propan-2-yl)silyloxyhex-5-en-3-yl]oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-[(2R,3R,4R)-2,4-dimethyl-1-tri(propan-2-yl)silyloxyhex-5-en-3-yl]oxy-dimethylsilane?
The canonical SMILES for tert-butyl-[(2R,3R,4R)-2,4-dimethyl-1-tri(propan-2-yl)silyloxyhex-5-en-3-yl]oxy-dimethylsilane is C=C[C@@H](C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](C)CO[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of tert-butyl-[(2R,3R,4R)-2,4-dimethyl-1-tri(propan-2-yl)silyloxyhex-5-en-3-yl]oxy-dimethylsilane?
The InChIKey is FBXXPZXLBWFVJJ-YPAWHYETSA-N. The full InChI is InChI=1S/C23H50O2Si2/c1-15-20(8)22(25-26(13,14)23(10,11)12)21(9)16-24-27(17(2)3,18(4)5)19(6)7/h15,17-22H,1,16H2,2-14H3/t20-,21-,22-/m1/s1.
What are the key properties of tert-butyl-[(2R,3R,4R)-2,4-dimethyl-1-tri(propan-2-yl)silyloxyhex-5-en-3-yl]oxy-dimethylsilane?
tert-butyl-[(2R,3R,4R)-2,4-dimethyl-1-tri(propan-2-yl)silyloxyhex-5-en-3-yl]oxy-dimethylsilane has a molecular weight of 414.82 g/mol, XLogP of 8.03, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(2R,3R,4R)-2,4-dimethyl-1-tri(propan-2-yl)silyloxyhex-5-en-3-yl]oxy-dimethylsilane is sourced from PubChem (CID 10525893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).