hex-5-enyl-dimethyl-(4-phenylbutan-2-yl)silane

C18H30Si — CID 146915207

IUPAChex-5-enyl-dimethyl-(4-phenylbutan-2-yl)silane
SMILESC=CCCCC[Si](C)(C)C(C)CCc1ccccc1
InChIInChI=1S/C18H30Si/c1-5-6-7-11-16-19(3,4)17(2)14-15-18-12-9-8-10-13-18/h5,8-10,12-13,17H,1,6-7,11,14-16H2,2-4H3
InChIKeyACCGXISHGDPSBY-UHFFFAOYSA-N
MW274.52 g/mol
LogP6.07
Rot. Bonds9

About hex-5-enyl-dimethyl-(4-phenylbutan-2-yl)silane

hex-5-enyl-dimethyl-(4-phenylbutan-2-yl)silane (PubChem CID 146915207) has the molecular formula C18H30Si and a molecular weight of 274.52 g/mol. Its IUPAC name is hex-5-enyl-dimethyl-(4-phenylbutan-2-yl)silane.

Molecular Properties

Compound Namehex-5-enyl-dimethyl-(4-phenylbutan-2-yl)silane
PubChem CID146915207
Molecular FormulaC18H30Si
Molecular Weight274.52 g/mol
Exact Mass274.21
IUPAC Namehex-5-enyl-dimethyl-(4-phenylbutan-2-yl)silane
SMILESC=CCCCC[Si](C)(C)C(C)CCc1ccccc1
InChIInChI=1S/C18H30Si/c1-5-6-7-11-16-19(3,4)17(2)14-15-18-12-9-8-10-13-18/h5,8-10,12-13,17H,1,6-7,11,14-16H2,2-4H3
InChIKeyACCGXISHGDPSBY-UHFFFAOYSA-N
XLogP6.07
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.52
LogP ≤ 56.07
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'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

dimethyl-(4-phenylbutan-2-yl)-(3,3,3-trifluoropropyl)silane
CID 142317297
hept-6-enylbenzene
CID 15608161
chloro-hex-5-enyl-methyl-phenylsilane
CID 54080342
chloro-methyl-oct-7-enyl-phenylsilane
CID 54527858
2-non-8-enyl-5-phenylpentane-1,3-diol
CID 71610289
but-3-enylbenzene;silver
CID 174999453
1-hex-5-enyl-4-phenylbenzene
CID 59235470
undec-10-en-2-ylbenzene
CID 140694797
tridec-12-en-2-ylbenzene
CID 140694820
[(3R)-3-pent-4-enoxyhex-5-enyl]benzene
CID 134882651
2-propylhept-6-enylbenzene
CID 123998172
trichloro(oct-7-en-2-yl)silane
CID 23208276

Frequently Asked Questions

What is the IUPAC name of hex-5-enyl-dimethyl-(4-phenylbutan-2-yl)silane?
The IUPAC name of hex-5-enyl-dimethyl-(4-phenylbutan-2-yl)silane (CID 146915207) is hex-5-enyl-dimethyl-(4-phenylbutan-2-yl)silane.
What is the SMILES notation for hex-5-enyl-dimethyl-(4-phenylbutan-2-yl)silane?
The canonical SMILES for hex-5-enyl-dimethyl-(4-phenylbutan-2-yl)silane is C=CCCCC[Si](C)(C)C(C)CCc1ccccc1.
What is the InChIKey of hex-5-enyl-dimethyl-(4-phenylbutan-2-yl)silane?
The InChIKey is ACCGXISHGDPSBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30Si/c1-5-6-7-11-16-19(3,4)17(2)14-15-18-12-9-8-10-13-18/h5,8-10,12-13,17H,1,6-7,11,14-16H2,2-4H3.
What are the key properties of hex-5-enyl-dimethyl-(4-phenylbutan-2-yl)silane?
hex-5-enyl-dimethyl-(4-phenylbutan-2-yl)silane has a molecular weight of 274.52 g/mol, XLogP of 6.07, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for hex-5-enyl-dimethyl-(4-phenylbutan-2-yl)silane is sourced from PubChem (CID 146915207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).