[(E)-2,5-dimethylhex-3-enyl]-tri(propan-2-yl)silane

C17H36Si — CID 10945460

IUPAC[(E)-2,5-dimethylhex-3-enyl]-tri(propan-2-yl)silane
SMILESCC(C)/C=C/C(C)C[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C17H36Si/c1-13(2)10-11-17(9)12-18(14(3)4,15(5)6)16(7)8/h10-11,13-17H,12H2,1-9H3/b11-10+
InChIKeyXIMQQRVSEHKDMG-ZHACJKMWSA-N
MW268.56 g/mol
LogP6.51
Rot. Bonds7

About [(E)-2,5-dimethylhex-3-enyl]-tri(propan-2-yl)silane

[(E)-2,5-dimethylhex-3-enyl]-tri(propan-2-yl)silane (PubChem CID 10945460) has the molecular formula C17H36Si and a molecular weight of 268.56 g/mol. Its IUPAC name is [(E)-2,5-dimethylhex-3-enyl]-tri(propan-2-yl)silane.

Molecular Properties

Compound Name[(E)-2,5-dimethylhex-3-enyl]-tri(propan-2-yl)silane
PubChem CID10945460
Molecular FormulaC17H36Si
Molecular Weight268.56 g/mol
Exact Mass268.26
IUPAC Name[(E)-2,5-dimethylhex-3-enyl]-tri(propan-2-yl)silane
SMILESCC(C)/C=C/C(C)C[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C17H36Si/c1-13(2)10-11-17(9)12-18(14(3)4,15(5)6)16(7)8/h10-11,13-17H,12H2,1-9H3/b11-10+
InChIKeyXIMQQRVSEHKDMG-ZHACJKMWSA-N
XLogP6.51
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500268.56
LogP ≤ 56.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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

Silane, trimethyl-3-penten-2-yl-, trans
CID 5366362
Silane, trimethyl-2-pentenyl-, (E)-
CID 5366396
Silane, triethyl-2-pentenyl-, (Z)-
CID 5370496
trimethyl-[(E)-4-methylpent-2-enyl]silane
CID 10986493
5-Methyl-2,6-cis-heptadienyltrimethylsilane
CID 12550622
[(Z)-4,4-dimethylpent-2-enyl]-trimethylsilane
CID 13215156
trimethyl-[(Z)-4-methylpent-2-enyl]silane
CID 13530519
Trimethyl[(2E)-1-methyl-2-butenyl]silane
CID 552124
2-Pentenyltrimethylsilane
CID 552260
Trimethyl-(3-pentenyl)silane
CID 59972038
triethyl-[(E)-pent-3-en-2-yl]silane
CID 21680737
(Hex-3-en-1-yl)(trimethyl)silane
CID 53439745

Frequently Asked Questions

What is the IUPAC name of [(E)-2,5-dimethylhex-3-enyl]-tri(propan-2-yl)silane?
The IUPAC name of [(E)-2,5-dimethylhex-3-enyl]-tri(propan-2-yl)silane (CID 10945460) is [(E)-2,5-dimethylhex-3-enyl]-tri(propan-2-yl)silane.
What is the SMILES notation for [(E)-2,5-dimethylhex-3-enyl]-tri(propan-2-yl)silane?
The canonical SMILES for [(E)-2,5-dimethylhex-3-enyl]-tri(propan-2-yl)silane is CC(C)/C=C/C(C)C[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of [(E)-2,5-dimethylhex-3-enyl]-tri(propan-2-yl)silane?
The InChIKey is XIMQQRVSEHKDMG-ZHACJKMWSA-N. The full InChI is InChI=1S/C17H36Si/c1-13(2)10-11-17(9)12-18(14(3)4,15(5)6)16(7)8/h10-11,13-17H,12H2,1-9H3/b11-10+.
What are the key properties of [(E)-2,5-dimethylhex-3-enyl]-tri(propan-2-yl)silane?
[(E)-2,5-dimethylhex-3-enyl]-tri(propan-2-yl)silane has a molecular weight of 268.56 g/mol, XLogP of 6.51, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-2,5-dimethylhex-3-enyl]-tri(propan-2-yl)silane is sourced from PubChem (CID 10945460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).