(3-butylcyclopenta-2,4-dien-1-ylidene)-methyl-pentylsilane

C15H26Si — CID 173079960

IUPAC(3-butylcyclopenta-2,4-dien-1-ylidene)-methyl-pentylsilane
SMILESCCCCC[Si](C)=C1C=CC(CCCC)=C1
InChIInChI=1S/C15H26Si/c1-4-6-8-12-16(3)15-11-10-14(13-15)9-7-5-2/h10-11,13H,4-9,12H2,1-3H3
InChIKeyWAMKTCGUTQRFBS-UHFFFAOYSA-N
MW234.46 g/mol
LogP4.74
Rot. Bonds7

About (3-butylcyclopenta-2,4-dien-1-ylidene)-methyl-pentylsilane

(3-butylcyclopenta-2,4-dien-1-ylidene)-methyl-pentylsilane (PubChem CID 173079960) has the molecular formula C15H26Si and a molecular weight of 234.46 g/mol. Its IUPAC name is (3-butylcyclopenta-2,4-dien-1-ylidene)-methyl-pentylsilane.

Molecular Properties

Compound Name(3-butylcyclopenta-2,4-dien-1-ylidene)-methyl-pentylsilane
PubChem CID173079960
Molecular FormulaC15H26Si
Molecular Weight234.46 g/mol
Exact Mass234.18
IUPAC Name(3-butylcyclopenta-2,4-dien-1-ylidene)-methyl-pentylsilane
SMILESCCCCC[Si](C)=C1C=CC(CCCC)=C1
InChIInChI=1S/C15H26Si/c1-4-6-8-12-16(3)15-11-10-14(13-15)9-7-5-2/h10-11,13H,4-9,12H2,1-3H3
InChIKeyWAMKTCGUTQRFBS-UHFFFAOYSA-N
XLogP4.74
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.46
LogP ≤ 54.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2-butyl-5-cyclobutylidenecyclopenta-1,3-diene
CID 151775012
CID 21462171
CID 21462171
5-methyl-2-nonylcyclopenta-1,3-diene
CID 101132027
5-methyl-2-tetradecylcyclopenta-1,3-diene
CID 90487597
CID 174866702
CID 174866702
2-heptadecylcyclopenta-1,3-diene
CID 91156945
3-butyl-1-[2-(3-butylcyclopenta-1,3-dien-1-yl)ethyl]cyclopenta-1,3-diene
CID 101202010
2,6,6-tributylcyclohexa-1,3-diene
CID 152708300
CID 137150635
CID 137150635
methyloctylsiloxane
CID 21243982
2-butyl-5-methylcyclopenta-1,3-diene;hafnium
CID 174884437
CID 137019124
CID 137019124

Frequently Asked Questions

What is the IUPAC name of (3-butylcyclopenta-2,4-dien-1-ylidene)-methyl-pentylsilane?
The IUPAC name of (3-butylcyclopenta-2,4-dien-1-ylidene)-methyl-pentylsilane (CID 173079960) is (3-butylcyclopenta-2,4-dien-1-ylidene)-methyl-pentylsilane.
What is the SMILES notation for (3-butylcyclopenta-2,4-dien-1-ylidene)-methyl-pentylsilane?
The canonical SMILES for (3-butylcyclopenta-2,4-dien-1-ylidene)-methyl-pentylsilane is CCCCC[Si](C)=C1C=CC(CCCC)=C1.
What is the InChIKey of (3-butylcyclopenta-2,4-dien-1-ylidene)-methyl-pentylsilane?
The InChIKey is WAMKTCGUTQRFBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26Si/c1-4-6-8-12-16(3)15-11-10-14(13-15)9-7-5-2/h10-11,13H,4-9,12H2,1-3H3.
What are the key properties of (3-butylcyclopenta-2,4-dien-1-ylidene)-methyl-pentylsilane?
(3-butylcyclopenta-2,4-dien-1-ylidene)-methyl-pentylsilane has a molecular weight of 234.46 g/mol, XLogP of 4.74, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3-butylcyclopenta-2,4-dien-1-ylidene)-methyl-pentylsilane is sourced from PubChem (CID 173079960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).