4-methyl-2-[tri(propan-2-yl)silylmethyl]pent-4-en-1-ol

C16H34OSi — CID 15248225

IUPAC4-methyl-2-[tri(propan-2-yl)silylmethyl]pent-4-en-1-ol
SMILESC=C(C)CC(CO)C[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C16H34OSi/c1-12(2)9-16(10-17)11-18(13(3)4,14(5)6)15(7)8/h13-17H,1,9-11H2,2-8H3
InChIKeyFFNLHOTWHOIMCJ-UHFFFAOYSA-N
MW270.53 g/mol
LogP5.24
Rot. Bonds8

About 4-methyl-2-[tri(propan-2-yl)silylmethyl]pent-4-en-1-ol

4-methyl-2-[tri(propan-2-yl)silylmethyl]pent-4-en-1-ol (PubChem CID 15248225) has the molecular formula C16H34OSi and a molecular weight of 270.53 g/mol. Its IUPAC name is 4-methyl-2-[tri(propan-2-yl)silylmethyl]pent-4-en-1-ol.

Molecular Properties

Compound Name4-methyl-2-[tri(propan-2-yl)silylmethyl]pent-4-en-1-ol
PubChem CID15248225
Molecular FormulaC16H34OSi
Molecular Weight270.53 g/mol
Exact Mass270.24
IUPAC Name4-methyl-2-[tri(propan-2-yl)silylmethyl]pent-4-en-1-ol
SMILESC=C(C)CC(CO)C[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C16H34OSi/c1-12(2)9-16(10-17)11-18(13(3)4,14(5)6)15(7)8/h13-17H,1,9-11H2,2-8H3
InChIKeyFFNLHOTWHOIMCJ-UHFFFAOYSA-N
XLogP5.24
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500270.53
LogP ≤ 55.24
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

4-(Trimethylsilylmethyl)pent-4-en-1-ol
CID 10975961
4-(Trimethylsilylmethyl)hexa-4,5-dien-1-ol
CID 101809715
(2R,3R)-2,4-dimethyl-3-trimethylsilylpent-4-en-1-ol
CID 10943201
(Z)-5-tributylstannyl-6-trimethylsilylhex-5-en-1-ol
CID 11190410
4-Methyl-2-(trimethylsilylmethyl)pent-4-en-1-ol
CID 11830158
tert-butyl-dimethyl-[(2S)-2-methyl-4-(trimethylsilylmethyl)pent-4-enoxy]silane
CID 57660050
4-Methyl-2-(3-(trimethylsilyl)prop-1-ene-2-yl)pentan-1-ol
CID 86691336
(2S)-2-methyl-4-(trimethylsilylmethyl)pent-4-en-1-ol
CID 89195487
(4S)-4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-5-methylhex-5-en-1-ol
CID 10516349
trimethyl-[(4R)-4-methyl-2-methylidene-5-tri(propan-2-yl)silyloxypentyl]silane
CID 11717129
(2R,3R)-5-methyl-3-(trimethylsilylmethyl)hex-5-en-2-ol
CID 15248229
2-(2-Methylidene-1-trimethylsilylcyclopropyl)ethanol
CID 21729618

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-[tri(propan-2-yl)silylmethyl]pent-4-en-1-ol?
The IUPAC name of 4-methyl-2-[tri(propan-2-yl)silylmethyl]pent-4-en-1-ol (CID 15248225) is 4-methyl-2-[tri(propan-2-yl)silylmethyl]pent-4-en-1-ol.
What is the SMILES notation for 4-methyl-2-[tri(propan-2-yl)silylmethyl]pent-4-en-1-ol?
The canonical SMILES for 4-methyl-2-[tri(propan-2-yl)silylmethyl]pent-4-en-1-ol is C=C(C)CC(CO)C[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of 4-methyl-2-[tri(propan-2-yl)silylmethyl]pent-4-en-1-ol?
The InChIKey is FFNLHOTWHOIMCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34OSi/c1-12(2)9-16(10-17)11-18(13(3)4,14(5)6)15(7)8/h13-17H,1,9-11H2,2-8H3.
What are the key properties of 4-methyl-2-[tri(propan-2-yl)silylmethyl]pent-4-en-1-ol?
4-methyl-2-[tri(propan-2-yl)silylmethyl]pent-4-en-1-ol has a molecular weight of 270.53 g/mol, XLogP of 5.24, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-[tri(propan-2-yl)silylmethyl]pent-4-en-1-ol is sourced from PubChem (CID 15248225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).