[2-methyl-3-(4-methylpent-3-enyl)cyclopenten-1-yl]oxy-tri(propan-2-yl)silane

C21H40OSi — CID 132560954

IUPAC[2-methyl-3-(4-methylpent-3-enyl)cyclopenten-1-yl]oxy-tri(propan-2-yl)silane
SMILESCC(C)=CCCC1CCC(O[Si](C(C)C)(C(C)C)C(C)C)=C1C
InChIInChI=1S/C21H40OSi/c1-15(2)11-10-12-20-13-14-21(19(20)9)22-23(16(3)4,17(5)6)18(7)8/h11,16-18,20H,10,12-14H2,1-9H3
InChIKeyYTOCWEZLZNVDMT-UHFFFAOYSA-N
MW336.64 g/mol
LogP7.61
Rot. Bonds8

About [2-methyl-3-(4-methylpent-3-enyl)cyclopenten-1-yl]oxy-tri(propan-2-yl)silane

[2-methyl-3-(4-methylpent-3-enyl)cyclopenten-1-yl]oxy-tri(propan-2-yl)silane (PubChem CID 132560954) has the molecular formula C21H40OSi and a molecular weight of 336.64 g/mol. Its IUPAC name is [2-methyl-3-(4-methylpent-3-enyl)cyclopenten-1-yl]oxy-tri(propan-2-yl)silane.

Molecular Properties

Compound Name[2-methyl-3-(4-methylpent-3-enyl)cyclopenten-1-yl]oxy-tri(propan-2-yl)silane
PubChem CID132560954
Molecular FormulaC21H40OSi
Molecular Weight336.64 g/mol
Exact Mass336.28
IUPAC Name[2-methyl-3-(4-methylpent-3-enyl)cyclopenten-1-yl]oxy-tri(propan-2-yl)silane
SMILESCC(C)=CCCC1CCC(O[Si](C(C)C)(C(C)C)C(C)C)=C1C
InChIInChI=1S/C21H40OSi/c1-15(2)11-10-12-20-13-14-21(19(20)9)22-23(16(3)4,17(5)6)18(7)8/h11,16-18,20H,10,12-14H2,1-9H3
InChIKeyYTOCWEZLZNVDMT-UHFFFAOYSA-N
XLogP7.61
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.64
LogP ≤ 57.61
H-Bond Donors ≤ 50
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

2-(tert-Butyldimethylsilyloxy)-4,4-difluoro-5-propyl-1-cyclopentene
CID 122389927
(3-Ethylcyclohexen-1-yl)oxy-trimethylsilane
CID 597987
(3-But-3-enylcyclopenten-1-yl)oxy-trimethylsilane
CID 10375839
Trimethyl-[3-(3-methylbut-3-enyl)cyclohexen-1-yl]oxysilane
CID 10490148
Trimethyl-[3-(4-methylpent-3-enyl)cyclohexen-1-yl]oxysilane
CID 10658496
[(3S)-3-ethylcyclohexen-1-yl]oxy-trimethylsilane
CID 11229389
[3-[2-(Cyclohexen-1-yl)ethyl]-3-methylcyclopenten-1-yl]oxy-trimethylsilane
CID 21593729
(S)-tert-butyl((3,7-dimethyloct-6-en-1-yl)oxy)dimethylsilane
CID 22882877
tert-butyl-[4-[(1R)-cyclohex-2-en-1-yl]-2-methylbutan-2-yl]oxy-dimethylsilane
CID 162400600
beta-Citronellol, TBDMS derivative
CID 11043851
Trimethyl-(3-methylcyclopentadecen-1-yl)oxysilane
CID 69502889
3,7-Dimethyloct-6-enoxy(triethyl)silane
CID 72751260

Frequently Asked Questions

What is the IUPAC name of [2-methyl-3-(4-methylpent-3-enyl)cyclopenten-1-yl]oxy-tri(propan-2-yl)silane?
The IUPAC name of [2-methyl-3-(4-methylpent-3-enyl)cyclopenten-1-yl]oxy-tri(propan-2-yl)silane (CID 132560954) is [2-methyl-3-(4-methylpent-3-enyl)cyclopenten-1-yl]oxy-tri(propan-2-yl)silane.
What is the SMILES notation for [2-methyl-3-(4-methylpent-3-enyl)cyclopenten-1-yl]oxy-tri(propan-2-yl)silane?
The canonical SMILES for [2-methyl-3-(4-methylpent-3-enyl)cyclopenten-1-yl]oxy-tri(propan-2-yl)silane is CC(C)=CCCC1CCC(O[Si](C(C)C)(C(C)C)C(C)C)=C1C.
What is the InChIKey of [2-methyl-3-(4-methylpent-3-enyl)cyclopenten-1-yl]oxy-tri(propan-2-yl)silane?
The InChIKey is YTOCWEZLZNVDMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H40OSi/c1-15(2)11-10-12-20-13-14-21(19(20)9)22-23(16(3)4,17(5)6)18(7)8/h11,16-18,20H,10,12-14H2,1-9H3.
What are the key properties of [2-methyl-3-(4-methylpent-3-enyl)cyclopenten-1-yl]oxy-tri(propan-2-yl)silane?
[2-methyl-3-(4-methylpent-3-enyl)cyclopenten-1-yl]oxy-tri(propan-2-yl)silane has a molecular weight of 336.64 g/mol, XLogP of 7.61, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methyl-3-(4-methylpent-3-enyl)cyclopenten-1-yl]oxy-tri(propan-2-yl)silane is sourced from PubChem (CID 132560954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).