(3Z)-1,5-dibutyl-3-pentylidene-4-silaspiro[3.4]octa-1,5-diene

C20H34Si — CID 139241206

IUPAC(3Z)-1,5-dibutyl-3-pentylidene-4-silaspiro[3.4]octa-1,5-diene
SMILESCCCC/C=C1/C=C(CCCC)[Si]12CCC=C2CCCC
InChIInChI=1S/C20H34Si/c1-4-7-10-14-20-17-19(13-9-6-3)21(20)16-11-15-18(21)12-8-5-2/h14-15,17H,4-13,16H2,1-3H3/b20-14-
InChIKeyPOGGINRSKOWJLA-ZHZULCJRSA-N
MW302.58 g/mol
LogP6.82
Rot. Bonds9

About (3Z)-1,5-dibutyl-3-pentylidene-4-silaspiro[3.4]octa-1,5-diene

(3Z)-1,5-dibutyl-3-pentylidene-4-silaspiro[3.4]octa-1,5-diene (PubChem CID 139241206) has the molecular formula C20H34Si and a molecular weight of 302.58 g/mol. Its IUPAC name is (3Z)-1,5-dibutyl-3-pentylidene-4-silaspiro[3.4]octa-1,5-diene.

Molecular Properties

Compound Name(3Z)-1,5-dibutyl-3-pentylidene-4-silaspiro[3.4]octa-1,5-diene
PubChem CID139241206
Molecular FormulaC20H34Si
Molecular Weight302.58 g/mol
Exact Mass302.24
IUPAC Name(3Z)-1,5-dibutyl-3-pentylidene-4-silaspiro[3.4]octa-1,5-diene
SMILESCCCC/C=C1/C=C(CCCC)[Si]12CCC=C2CCCC
InChIInChI=1S/C20H34Si/c1-4-7-10-14-20-17-19(13-9-6-3)21(20)16-11-15-18(21)12-8-5-2/h14-15,17H,4-13,16H2,1-3H3/b20-14-
InChIKeyPOGGINRSKOWJLA-ZHZULCJRSA-N
XLogP6.82
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500302.58
LogP ≤ 56.82
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

(1S)-5-butyl-1-chloro-1-phenyl-2,3-dihydrosilole
CID 102283936
1,2-di(pentylidene)cyclohexane
CID 11356709
1,2,3,4,5,6-hexabutylbenzene
CID 12586860
pentylidenecyclopentadecane
CID 151655236
2,5-dibutyl-3-ethyl-1,1-dimethylsilole
CID 15151076
3-butyl-1-[2-(3-butylcyclopenta-1,3-dien-1-yl)ethyl]cyclopenta-1,3-diene
CID 101202010
2,6-di(pentylidene)cyclohexan-1-one
CID 70979876
2,6-dimethyl-4-pentylidenebicyclo[3.1.0]hexane
CID 123191792
heptadecylidenecyclopropane
CID 19760704
1-butylcyclononene
CID 56981158
pent-1-ene;pentylidenecyclopropane
CID 173050436
6-[(E)-non-4-enyl]-3,4-dihydro-1H-pyridin-2-one
CID 134894496

Frequently Asked Questions

What is the IUPAC name of (3Z)-1,5-dibutyl-3-pentylidene-4-silaspiro[3.4]octa-1,5-diene?
The IUPAC name of (3Z)-1,5-dibutyl-3-pentylidene-4-silaspiro[3.4]octa-1,5-diene (CID 139241206) is (3Z)-1,5-dibutyl-3-pentylidene-4-silaspiro[3.4]octa-1,5-diene.
What is the SMILES notation for (3Z)-1,5-dibutyl-3-pentylidene-4-silaspiro[3.4]octa-1,5-diene?
The canonical SMILES for (3Z)-1,5-dibutyl-3-pentylidene-4-silaspiro[3.4]octa-1,5-diene is CCCC/C=C1/C=C(CCCC)[Si]12CCC=C2CCCC.
What is the InChIKey of (3Z)-1,5-dibutyl-3-pentylidene-4-silaspiro[3.4]octa-1,5-diene?
The InChIKey is POGGINRSKOWJLA-ZHZULCJRSA-N. The full InChI is InChI=1S/C20H34Si/c1-4-7-10-14-20-17-19(13-9-6-3)21(20)16-11-15-18(21)12-8-5-2/h14-15,17H,4-13,16H2,1-3H3/b20-14-.
What are the key properties of (3Z)-1,5-dibutyl-3-pentylidene-4-silaspiro[3.4]octa-1,5-diene?
(3Z)-1,5-dibutyl-3-pentylidene-4-silaspiro[3.4]octa-1,5-diene has a molecular weight of 302.58 g/mol, XLogP of 6.82, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-1,5-dibutyl-3-pentylidene-4-silaspiro[3.4]octa-1,5-diene is sourced from PubChem (CID 139241206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).