[(Z)-3-bromopent-3-enoxy]-tri(propan-2-yl)silane

C14H29BrOSi — CID 135060372

IUPAC[(Z)-3-bromopent-3-enoxy]-tri(propan-2-yl)silane
SMILESC/C=C(\Br)CCO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C14H29BrOSi/c1-8-14(15)9-10-16-17(11(2)3,12(4)5)13(6)7/h8,11-13H,9-10H2,1-7H3/b14-8-
InChIKeyVJMYRBNOALZIOU-ZSOIEALJSA-N
MW321.38 g/mol
LogP5.87
Rot. Bonds7

About [(Z)-3-bromopent-3-enoxy]-tri(propan-2-yl)silane

[(Z)-3-bromopent-3-enoxy]-tri(propan-2-yl)silane (PubChem CID 135060372) has the molecular formula C14H29BrOSi and a molecular weight of 321.38 g/mol. Its IUPAC name is [(Z)-3-bromopent-3-enoxy]-tri(propan-2-yl)silane.

Molecular Properties

Compound Name[(Z)-3-bromopent-3-enoxy]-tri(propan-2-yl)silane
PubChem CID135060372
Molecular FormulaC14H29BrOSi
Molecular Weight321.38 g/mol
Exact Mass320.12
IUPAC Name[(Z)-3-bromopent-3-enoxy]-tri(propan-2-yl)silane
SMILESC/C=C(\Br)CCO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C14H29BrOSi/c1-8-14(15)9-10-16-17(11(2)3,12(4)5)13(6)7/h8,11-13H,9-10H2,1-7H3/b14-8-
InChIKeyVJMYRBNOALZIOU-ZSOIEALJSA-N
XLogP5.87
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500321.38
LogP ≤ 55.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(Z)-3-bromopent-3-enoxy]-tri(propan-2-yl)silane?
The IUPAC name of [(Z)-3-bromopent-3-enoxy]-tri(propan-2-yl)silane (CID 135060372) is [(Z)-3-bromopent-3-enoxy]-tri(propan-2-yl)silane.
What is the SMILES notation for [(Z)-3-bromopent-3-enoxy]-tri(propan-2-yl)silane?
The canonical SMILES for [(Z)-3-bromopent-3-enoxy]-tri(propan-2-yl)silane is C/C=C(\Br)CCO[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of [(Z)-3-bromopent-3-enoxy]-tri(propan-2-yl)silane?
The InChIKey is VJMYRBNOALZIOU-ZSOIEALJSA-N. The full InChI is InChI=1S/C14H29BrOSi/c1-8-14(15)9-10-16-17(11(2)3,12(4)5)13(6)7/h8,11-13H,9-10H2,1-7H3/b14-8-.
What are the key properties of [(Z)-3-bromopent-3-enoxy]-tri(propan-2-yl)silane?
[(Z)-3-bromopent-3-enoxy]-tri(propan-2-yl)silane has a molecular weight of 321.38 g/mol, XLogP of 5.87, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-3-bromopent-3-enoxy]-tri(propan-2-yl)silane is sourced from PubChem (CID 135060372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).