5-methylidene-1,1-bis(triethylsilyl)hept-1-en-3-ol

C20H42OSi2 — CID 135021407

IUPAC5-methylidene-1,1-bis(triethylsilyl)hept-1-en-3-ol
SMILESC=C(CC)CC(O)C=C([Si](CC)(CC)CC)[Si](CC)(CC)CC
InChIInChI=1S/C20H42OSi2/c1-9-18(8)16-19(21)17-20(22(10-2,11-3)12-4)23(13-5,14-6)15-7/h17,19,21H,8-16H2,1-7H3
InChIKeySUWXGVYCMQUDDW-UHFFFAOYSA-N
MW354.73 g/mol
LogP6.73
Rot. Bonds12

About 5-methylidene-1,1-bis(triethylsilyl)hept-1-en-3-ol

5-methylidene-1,1-bis(triethylsilyl)hept-1-en-3-ol (PubChem CID 135021407) has the molecular formula C20H42OSi2 and a molecular weight of 354.73 g/mol. Its IUPAC name is 5-methylidene-1,1-bis(triethylsilyl)hept-1-en-3-ol.

Molecular Properties

Compound Name5-methylidene-1,1-bis(triethylsilyl)hept-1-en-3-ol
PubChem CID135021407
Molecular FormulaC20H42OSi2
Molecular Weight354.73 g/mol
Exact Mass354.28
IUPAC Name5-methylidene-1,1-bis(triethylsilyl)hept-1-en-3-ol
SMILESC=C(CC)CC(O)C=C([Si](CC)(CC)CC)[Si](CC)(CC)CC
InChIInChI=1S/C20H42OSi2/c1-9-18(8)16-19(21)17-20(22(10-2,11-3)12-4)23(13-5,14-6)15-7/h17,19,21H,8-16H2,1-7H3
InChIKeySUWXGVYCMQUDDW-UHFFFAOYSA-N
XLogP6.73
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.73
LogP ≤ 56.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 5-methylidene-1,1-bis(triethylsilyl)hept-1-en-3-ol 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 5-methylidene-1,1-bis(triethylsilyl)hept-1-en-3-ol?
The IUPAC name of 5-methylidene-1,1-bis(triethylsilyl)hept-1-en-3-ol (CID 135021407) is 5-methylidene-1,1-bis(triethylsilyl)hept-1-en-3-ol.
What is the SMILES notation for 5-methylidene-1,1-bis(triethylsilyl)hept-1-en-3-ol?
The canonical SMILES for 5-methylidene-1,1-bis(triethylsilyl)hept-1-en-3-ol is C=C(CC)CC(O)C=C([Si](CC)(CC)CC)[Si](CC)(CC)CC.
What is the InChIKey of 5-methylidene-1,1-bis(triethylsilyl)hept-1-en-3-ol?
The InChIKey is SUWXGVYCMQUDDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H42OSi2/c1-9-18(8)16-19(21)17-20(22(10-2,11-3)12-4)23(13-5,14-6)15-7/h17,19,21H,8-16H2,1-7H3.
What are the key properties of 5-methylidene-1,1-bis(triethylsilyl)hept-1-en-3-ol?
5-methylidene-1,1-bis(triethylsilyl)hept-1-en-3-ol has a molecular weight of 354.73 g/mol, XLogP of 6.73, 12 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylidene-1,1-bis(triethylsilyl)hept-1-en-3-ol is sourced from PubChem (CID 135021407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).