3-trimethylsilyltrideca-1,2-dien-4-ol

C16H32OSi — CID 71484217

IUPAC3-trimethylsilyltrideca-1,2-dien-4-ol
SMILESC=C=C(C(O)CCCCCCCCC)[Si](C)(C)C
InChIInChI=1S/C16H32OSi/c1-6-8-9-10-11-12-13-14-15(17)16(7-2)18(3,4)5/h15,17H,2,6,8-14H2,1,3-5H3
InChIKeyYKLDSLRRPGZEOR-UHFFFAOYSA-N
MW268.52 g/mol
LogP5.08
Rot. Bonds10

About 3-trimethylsilyltrideca-1,2-dien-4-ol

3-trimethylsilyltrideca-1,2-dien-4-ol (PubChem CID 71484217) has the molecular formula C16H32OSi and a molecular weight of 268.52 g/mol. Its IUPAC name is 3-trimethylsilyltrideca-1,2-dien-4-ol.

Molecular Properties

Compound Name3-trimethylsilyltrideca-1,2-dien-4-ol
PubChem CID71484217
Molecular FormulaC16H32OSi
Molecular Weight268.52 g/mol
Exact Mass268.22
IUPAC Name3-trimethylsilyltrideca-1,2-dien-4-ol
SMILESC=C=C(C(O)CCCCCCCCC)[Si](C)(C)C
InChIInChI=1S/C16H32OSi/c1-6-8-9-10-11-12-13-14-15(17)16(7-2)18(3,4)5/h15,17H,2,6,8-14H2,1,3-5H3
InChIKeyYKLDSLRRPGZEOR-UHFFFAOYSA-N
XLogP5.08
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500268.52
LogP ≤ 55.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-trimethylsilyltrideca-1,2-dien-4-ol?
The IUPAC name of 3-trimethylsilyltrideca-1,2-dien-4-ol (CID 71484217) is 3-trimethylsilyltrideca-1,2-dien-4-ol.
What is the SMILES notation for 3-trimethylsilyltrideca-1,2-dien-4-ol?
The canonical SMILES for 3-trimethylsilyltrideca-1,2-dien-4-ol is C=C=C(C(O)CCCCCCCCC)[Si](C)(C)C.
What is the InChIKey of 3-trimethylsilyltrideca-1,2-dien-4-ol?
The InChIKey is YKLDSLRRPGZEOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32OSi/c1-6-8-9-10-11-12-13-14-15(17)16(7-2)18(3,4)5/h15,17H,2,6,8-14H2,1,3-5H3.
What are the key properties of 3-trimethylsilyltrideca-1,2-dien-4-ol?
3-trimethylsilyltrideca-1,2-dien-4-ol has a molecular weight of 268.52 g/mol, XLogP of 5.08, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-trimethylsilyltrideca-1,2-dien-4-ol is sourced from PubChem (CID 71484217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).