2-but-3-en-2-yloct-1-enyl(trimethyl)silane;chlorozinc(1+)

C15H29ClSiZn — CID 135008031

IUPAC2-but-3-en-2-yloct-1-enyl(trimethyl)silane;chlorozinc(1+)
SMILESC=CC(C)/C(=[C-]/[Si](C)(C)C)CCCCCC.Cl[Zn+]
InChIInChI=1S/C15H29Si.ClH.Zn/c1-7-9-10-11-12-15(14(3)8-2)13-16(4,5)6;;/h8,14H,2,7,9-12H2,1,3-6H3;1H;/q-1;;+2/p-1
InChIKeyRXFFXNASIZMGSL-UHFFFAOYSA-M
MW338.33 g/mol
LogP6.07
Rot. Bonds8

About 2-but-3-en-2-yloct-1-enyl(trimethyl)silane;chlorozinc(1+)

2-but-3-en-2-yloct-1-enyl(trimethyl)silane;chlorozinc(1+) (PubChem CID 135008031) has the molecular formula C15H29ClSiZn and a molecular weight of 338.33 g/mol. Its IUPAC name is 2-but-3-en-2-yloct-1-enyl(trimethyl)silane;chlorozinc(1+).

Molecular Properties

Compound Name2-but-3-en-2-yloct-1-enyl(trimethyl)silane;chlorozinc(1+)
PubChem CID135008031
Molecular FormulaC15H29ClSiZn
Molecular Weight338.33 g/mol
Exact Mass336.10
IUPAC Name2-but-3-en-2-yloct-1-enyl(trimethyl)silane;chlorozinc(1+)
SMILESC=CC(C)/C(=[C-]/[Si](C)(C)C)CCCCCC.Cl[Zn+]
InChIInChI=1S/C15H29Si.ClH.Zn/c1-7-9-10-11-12-15(14(3)8-2)13-16(4,5)6;;/h8,14H,2,7,9-12H2,1,3-6H3;1H;/q-1;;+2/p-1
InChIKeyRXFFXNASIZMGSL-UHFFFAOYSA-M
XLogP6.07
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.33
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': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

[(E)-2-[(1R,2R)-2-hexylcyclopropyl]ethenyl]-trimethylsilane
CID 11424639
magnesium;trimethyl-[(E)-7-methyloct-1-enyl]silane;chloride
CID 11807321
Trimethyl(3-methylnon-1-en-3-yl)silane
CID 134980981
[(E)-2-[(1R,2R)-2-butylcyclopropyl]ethenyl]-trimethylsilane
CID 135057231
Silane, [1-(5-hexenyl)-2-methylenecyclopropyl]trimethyl-
CID 552265
tert-butyl-dimethyl-[(E,3R)-3-methyloct-1-enyl]silane
CID 102273768
[(E)-2-but-3-en-2-yloct-1-enyl]-trimethylsilane
CID 13180811
Trimethyl(5-methylpentadec-14-en-6-yl)silane
CID 20725099
6-(Trimethylsilyl)-hexylcycloprop-2-ene
CID 67373233
2-But-3-en-2-yloct-1-enyl(trimethyl)silane
CID 73167229
Dichloro(2-ethenyloctyl)silane
CID 123660297
Bromozinc(1+);3-(2,2-dimethylpropyl)octa-1,2,7-trienyl-trimethylsilane
CID 10385984

Frequently Asked Questions

What is the IUPAC name of 2-but-3-en-2-yloct-1-enyl(trimethyl)silane;chlorozinc(1+)?
The IUPAC name of 2-but-3-en-2-yloct-1-enyl(trimethyl)silane;chlorozinc(1+) (CID 135008031) is 2-but-3-en-2-yloct-1-enyl(trimethyl)silane;chlorozinc(1+).
What is the SMILES notation for 2-but-3-en-2-yloct-1-enyl(trimethyl)silane;chlorozinc(1+)?
The canonical SMILES for 2-but-3-en-2-yloct-1-enyl(trimethyl)silane;chlorozinc(1+) is C=CC(C)/C(=[C-]/[Si](C)(C)C)CCCCCC.Cl[Zn+].
What is the InChIKey of 2-but-3-en-2-yloct-1-enyl(trimethyl)silane;chlorozinc(1+)?
The InChIKey is RXFFXNASIZMGSL-UHFFFAOYSA-M. The full InChI is InChI=1S/C15H29Si.ClH.Zn/c1-7-9-10-11-12-15(14(3)8-2)13-16(4,5)6;;/h8,14H,2,7,9-12H2,1,3-6H3;1H;/q-1;;+2/p-1.
What are the key properties of 2-but-3-en-2-yloct-1-enyl(trimethyl)silane;chlorozinc(1+)?
2-but-3-en-2-yloct-1-enyl(trimethyl)silane;chlorozinc(1+) has a molecular weight of 338.33 g/mol, XLogP of 6.07, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-but-3-en-2-yloct-1-enyl(trimethyl)silane;chlorozinc(1+) is sourced from PubChem (CID 135008031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).