4-[2-[dimethyl(prop-2-enyl)silyl]ethyl]heptan-4-ol

C14H30OSi — CID 10633957

IUPAC4-[2-[dimethyl(prop-2-enyl)silyl]ethyl]heptan-4-ol
SMILESC=CC[Si](C)(C)CCC(O)(CCC)CCC
InChIInChI=1S/C14H30OSi/c1-6-9-14(15,10-7-2)11-13-16(4,5)12-8-3/h8,15H,3,6-7,9-13H2,1-2,4-5H3
InChIKeyVKSPSXSUWLLWIK-UHFFFAOYSA-N
MW242.48 g/mol
LogP4.60
Rot. Bonds9

About 4-[2-[dimethyl(prop-2-enyl)silyl]ethyl]heptan-4-ol

4-[2-[dimethyl(prop-2-enyl)silyl]ethyl]heptan-4-ol (PubChem CID 10633957) has the molecular formula C14H30OSi and a molecular weight of 242.48 g/mol. Its IUPAC name is 4-[2-[dimethyl(prop-2-enyl)silyl]ethyl]heptan-4-ol.

Molecular Properties

Compound Name4-[2-[dimethyl(prop-2-enyl)silyl]ethyl]heptan-4-ol
PubChem CID10633957
Molecular FormulaC14H30OSi
Molecular Weight242.48 g/mol
Exact Mass242.21
IUPAC Name4-[2-[dimethyl(prop-2-enyl)silyl]ethyl]heptan-4-ol
SMILESC=CC[Si](C)(C)CCC(O)(CCC)CCC
InChIInChI=1S/C14H30OSi/c1-6-9-14(15,10-7-2)11-13-16(4,5)12-8-3/h8,15H,3,6-7,9-13H2,1-2,4-5H3
InChIKeyVKSPSXSUWLLWIK-UHFFFAOYSA-N
XLogP4.60
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.48
LogP ≤ 54.60
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'}

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Related Compounds

1-[2-[Dimethyl(prop-2-enyl)silyl]ethyl]cyclohexan-1-ol
CID 10537262
(E)-4-propyl-1-trimethylsilylhept-1-en-4-ol
CID 11379192
4-Methyl-1-tris(prop-2-enyl)silyloct-1-yn-4-ol
CID 88828758
4-Methyl-1,7-bis[tris(prop-2-enyl)silyl]heptan-4-ol
CID 140647208
4-Ethylheptan-4-yloxy(prop-2-enyl)silane
CID 173174957
4-Methylheptan-4-yloxy(prop-2-enyl)silane
CID 173175184
5-(2-Trimethylsilylethynyl)nona-1,8-dien-5-ol
CID 10514010
1-[2-[Dimethyl(prop-2-enyl)silyl]ethyl]cyclopentan-1-ol
CID 10751057
4-[3-(Trimethylsilyl)propyl]hepta-1,6-dien-4-ol
CID 13149361

Frequently Asked Questions

What is the IUPAC name of 4-[2-[dimethyl(prop-2-enyl)silyl]ethyl]heptan-4-ol?
The IUPAC name of 4-[2-[dimethyl(prop-2-enyl)silyl]ethyl]heptan-4-ol (CID 10633957) is 4-[2-[dimethyl(prop-2-enyl)silyl]ethyl]heptan-4-ol.
What is the SMILES notation for 4-[2-[dimethyl(prop-2-enyl)silyl]ethyl]heptan-4-ol?
The canonical SMILES for 4-[2-[dimethyl(prop-2-enyl)silyl]ethyl]heptan-4-ol is C=CC[Si](C)(C)CCC(O)(CCC)CCC.
What is the InChIKey of 4-[2-[dimethyl(prop-2-enyl)silyl]ethyl]heptan-4-ol?
The InChIKey is VKSPSXSUWLLWIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30OSi/c1-6-9-14(15,10-7-2)11-13-16(4,5)12-8-3/h8,15H,3,6-7,9-13H2,1-2,4-5H3.
What are the key properties of 4-[2-[dimethyl(prop-2-enyl)silyl]ethyl]heptan-4-ol?
4-[2-[dimethyl(prop-2-enyl)silyl]ethyl]heptan-4-ol has a molecular weight of 242.48 g/mol, XLogP of 4.60, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[dimethyl(prop-2-enyl)silyl]ethyl]heptan-4-ol is sourced from PubChem (CID 10633957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).