tert-butyl-dimethyl-[(1S)-3,5,5-trimethyl-4-methylidenecyclohex-2-en-1-yl]oxysilane

C16H30OSi — CID 58692763

IUPACtert-butyl-dimethyl-[(1S)-3,5,5-trimethyl-4-methylidenecyclohex-2-en-1-yl]oxysilane
SMILESC=C1C(C)=C[C@@H](O[Si](C)(C)C(C)(C)C)CC1(C)C
InChIInChI=1S/C16H30OSi/c1-12-10-14(11-16(6,7)13(12)2)17-18(8,9)15(3,4)5/h10,14H,2,11H2,1,3-9H3/t14-/m1/s1
InChIKeyKWMOIDQAKLDVAD-CQSZACIVSA-N
MW266.50 g/mol
LogP5.31
Rot. Bonds2

About tert-butyl-dimethyl-[(1S)-3,5,5-trimethyl-4-methylidenecyclohex-2-en-1-yl]oxysilane

tert-butyl-dimethyl-[(1S)-3,5,5-trimethyl-4-methylidenecyclohex-2-en-1-yl]oxysilane (PubChem CID 58692763) has the molecular formula C16H30OSi and a molecular weight of 266.50 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(1S)-3,5,5-trimethyl-4-methylidenecyclohex-2-en-1-yl]oxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(1S)-3,5,5-trimethyl-4-methylidenecyclohex-2-en-1-yl]oxysilane
PubChem CID58692763
Molecular FormulaC16H30OSi
Molecular Weight266.50 g/mol
Exact Mass266.21
IUPAC Nametert-butyl-dimethyl-[(1S)-3,5,5-trimethyl-4-methylidenecyclohex-2-en-1-yl]oxysilane
SMILESC=C1C(C)=C[C@@H](O[Si](C)(C)C(C)(C)C)CC1(C)C
InChIInChI=1S/C16H30OSi/c1-12-10-14(11-16(6,7)13(12)2)17-18(8,9)15(3,4)5/h10,14H,2,11H2,1,3-9H3/t14-/m1/s1
InChIKeyKWMOIDQAKLDVAD-CQSZACIVSA-N
XLogP5.31
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.50
LogP ≤ 55.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(1S)-3,5,5-trimethyl-4-methylidenecyclohex-2-en-1-yl]oxysilane?
The IUPAC name of tert-butyl-dimethyl-[(1S)-3,5,5-trimethyl-4-methylidenecyclohex-2-en-1-yl]oxysilane (CID 58692763) is tert-butyl-dimethyl-[(1S)-3,5,5-trimethyl-4-methylidenecyclohex-2-en-1-yl]oxysilane.
What is the SMILES notation for tert-butyl-dimethyl-[(1S)-3,5,5-trimethyl-4-methylidenecyclohex-2-en-1-yl]oxysilane?
The canonical SMILES for tert-butyl-dimethyl-[(1S)-3,5,5-trimethyl-4-methylidenecyclohex-2-en-1-yl]oxysilane is C=C1C(C)=C[C@@H](O[Si](C)(C)C(C)(C)C)CC1(C)C.
What is the InChIKey of tert-butyl-dimethyl-[(1S)-3,5,5-trimethyl-4-methylidenecyclohex-2-en-1-yl]oxysilane?
The InChIKey is KWMOIDQAKLDVAD-CQSZACIVSA-N. The full InChI is InChI=1S/C16H30OSi/c1-12-10-14(11-16(6,7)13(12)2)17-18(8,9)15(3,4)5/h10,14H,2,11H2,1,3-9H3/t14-/m1/s1.
What are the key properties of tert-butyl-dimethyl-[(1S)-3,5,5-trimethyl-4-methylidenecyclohex-2-en-1-yl]oxysilane?
tert-butyl-dimethyl-[(1S)-3,5,5-trimethyl-4-methylidenecyclohex-2-en-1-yl]oxysilane has a molecular weight of 266.50 g/mol, XLogP of 5.31, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(1S)-3,5,5-trimethyl-4-methylidenecyclohex-2-en-1-yl]oxysilane is sourced from PubChem (CID 58692763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).