tert-butyl-dimethyl-[(4R,8R,9S)-8-methyl-6-methylidene-10-phenylmethoxy-9-tri(propan-2-yl)silyloxydecan-4-yl]oxysilane

C34H64O3Si2 — CID 11284605

IUPACtert-butyl-dimethyl-[(4R,8R,9S)-8-methyl-6-methylidene-10-phenylmethoxy-9-tri(propan-2-yl)silyloxydecan-4-yl]oxysilane
SMILESC=C(C[C@@H](CCC)O[Si](C)(C)C(C)(C)C)C[C@@H](C)[C@@H](COCc1ccccc1)O[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C34H64O3Si2/c1-15-19-32(36-38(13,14)34(10,11)12)23-29(8)22-30(9)33(25-35-24-31-20-17-16-18-21-31)37-39(26(2)3,27(4)5)28(6)7/h16-18,20-21,26-28,30,32-33H,8,15,19,22-25H2,1-7,9-14H3/t30-,32-,33-/m1/s1
InChIKeyQYHFPAACWIDAFB-JORIVFIJSA-N
MW577.06 g/mol
LogP10.93
Rot. Bonds18

About tert-butyl-dimethyl-[(4R,8R,9S)-8-methyl-6-methylidene-10-phenylmethoxy-9-tri(propan-2-yl)silyloxydecan-4-yl]oxysilane

tert-butyl-dimethyl-[(4R,8R,9S)-8-methyl-6-methylidene-10-phenylmethoxy-9-tri(propan-2-yl)silyloxydecan-4-yl]oxysilane (PubChem CID 11284605) has the molecular formula C34H64O3Si2 and a molecular weight of 577.06 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(4R,8R,9S)-8-methyl-6-methylidene-10-phenylmethoxy-9-tri(propan-2-yl)silyloxydecan-4-yl]oxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(4R,8R,9S)-8-methyl-6-methylidene-10-phenylmethoxy-9-tri(propan-2-yl)silyloxydecan-4-yl]oxysilane
PubChem CID11284605
Molecular FormulaC34H64O3Si2
Molecular Weight577.06 g/mol
Exact Mass576.44
IUPAC Nametert-butyl-dimethyl-[(4R,8R,9S)-8-methyl-6-methylidene-10-phenylmethoxy-9-tri(propan-2-yl)silyloxydecan-4-yl]oxysilane
SMILESC=C(C[C@@H](CCC)O[Si](C)(C)C(C)(C)C)C[C@@H](C)[C@@H](COCc1ccccc1)O[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C34H64O3Si2/c1-15-19-32(36-38(13,14)34(10,11)12)23-29(8)22-30(9)33(25-35-24-31-20-17-16-18-21-31)37-39(26(2)3,27(4)5)28(6)7/h16-18,20-21,26-28,30,32-33H,8,15,19,22-25H2,1-7,9-14H3/t30-,32-,33-/m1/s1
InChIKeyQYHFPAACWIDAFB-JORIVFIJSA-N
XLogP10.93
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds18
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500577.06
LogP ≤ 510.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze tert-butyl-dimethyl-[(4R,8R,9S)-8-methyl-6-methylidene-10-phenylmethoxy-9-tri(propan-2-yl)silyloxydecan-4-yl]oxysilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(4R,8R,9S)-8-methyl-6-methylidene-10-phenylmethoxy-9-tri(propan-2-yl)silyloxydecan-4-yl]oxysilane?
The IUPAC name of tert-butyl-dimethyl-[(4R,8R,9S)-8-methyl-6-methylidene-10-phenylmethoxy-9-tri(propan-2-yl)silyloxydecan-4-yl]oxysilane (CID 11284605) is tert-butyl-dimethyl-[(4R,8R,9S)-8-methyl-6-methylidene-10-phenylmethoxy-9-tri(propan-2-yl)silyloxydecan-4-yl]oxysilane.
What is the SMILES notation for tert-butyl-dimethyl-[(4R,8R,9S)-8-methyl-6-methylidene-10-phenylmethoxy-9-tri(propan-2-yl)silyloxydecan-4-yl]oxysilane?
The canonical SMILES for tert-butyl-dimethyl-[(4R,8R,9S)-8-methyl-6-methylidene-10-phenylmethoxy-9-tri(propan-2-yl)silyloxydecan-4-yl]oxysilane is C=C(C[C@@H](CCC)O[Si](C)(C)C(C)(C)C)C[C@@H](C)[C@@H](COCc1ccccc1)O[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of tert-butyl-dimethyl-[(4R,8R,9S)-8-methyl-6-methylidene-10-phenylmethoxy-9-tri(propan-2-yl)silyloxydecan-4-yl]oxysilane?
The InChIKey is QYHFPAACWIDAFB-JORIVFIJSA-N. The full InChI is InChI=1S/C34H64O3Si2/c1-15-19-32(36-38(13,14)34(10,11)12)23-29(8)22-30(9)33(25-35-24-31-20-17-16-18-21-31)37-39(26(2)3,27(4)5)28(6)7/h16-18,20-21,26-28,30,32-33H,8,15,19,22-25H2,1-7,9-14H3/t30-,32-,33-/m1/s1.
What are the key properties of tert-butyl-dimethyl-[(4R,8R,9S)-8-methyl-6-methylidene-10-phenylmethoxy-9-tri(propan-2-yl)silyloxydecan-4-yl]oxysilane?
tert-butyl-dimethyl-[(4R,8R,9S)-8-methyl-6-methylidene-10-phenylmethoxy-9-tri(propan-2-yl)silyloxydecan-4-yl]oxysilane has a molecular weight of 577.06 g/mol, XLogP of 10.93, 18 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(4R,8R,9S)-8-methyl-6-methylidene-10-phenylmethoxy-9-tri(propan-2-yl)silyloxydecan-4-yl]oxysilane is sourced from PubChem (CID 11284605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).