(Z)-4-iodo-3-methyl-4-trimethylsilylbut-3-en-1-ol

C8H17IOSi — CID 10660677

IUPAC(Z)-4-iodo-3-methyl-4-trimethylsilylbut-3-en-1-ol
SMILESC/C(CCO)=C(/I)[Si](C)(C)C
InChIInChI=1S/C8H17IOSi/c1-7(5-6-10)8(9)11(2,3)4/h10H,5-6H2,1-4H3/b8-7+
InChIKeyGGJTZCXPCSYRFZ-BQYQJAHWSA-N
MW284.21 g/mol
LogP2.96
Rot. Bonds3

About (Z)-4-iodo-3-methyl-4-trimethylsilylbut-3-en-1-ol

(Z)-4-iodo-3-methyl-4-trimethylsilylbut-3-en-1-ol (PubChem CID 10660677) has the molecular formula C8H17IOSi and a molecular weight of 284.21 g/mol. Its IUPAC name is (Z)-4-iodo-3-methyl-4-trimethylsilylbut-3-en-1-ol.

Molecular Properties

Compound Name(Z)-4-iodo-3-methyl-4-trimethylsilylbut-3-en-1-ol
PubChem CID10660677
Molecular FormulaC8H17IOSi
Molecular Weight284.21 g/mol
Exact Mass284.01
IUPAC Name(Z)-4-iodo-3-methyl-4-trimethylsilylbut-3-en-1-ol
SMILESC/C(CCO)=C(/I)[Si](C)(C)C
InChIInChI=1S/C8H17IOSi/c1-7(5-6-10)8(9)11(2,3)4/h10H,5-6H2,1-4H3/b8-7+
InChIKeyGGJTZCXPCSYRFZ-BQYQJAHWSA-N
XLogP2.96
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.21
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-4-iodo-3-methyl-4-trimethylsilylbut-3-en-1-ol?
The IUPAC name of (Z)-4-iodo-3-methyl-4-trimethylsilylbut-3-en-1-ol (CID 10660677) is (Z)-4-iodo-3-methyl-4-trimethylsilylbut-3-en-1-ol.
What is the SMILES notation for (Z)-4-iodo-3-methyl-4-trimethylsilylbut-3-en-1-ol?
The canonical SMILES for (Z)-4-iodo-3-methyl-4-trimethylsilylbut-3-en-1-ol is C/C(CCO)=C(/I)[Si](C)(C)C.
What is the InChIKey of (Z)-4-iodo-3-methyl-4-trimethylsilylbut-3-en-1-ol?
The InChIKey is GGJTZCXPCSYRFZ-BQYQJAHWSA-N. The full InChI is InChI=1S/C8H17IOSi/c1-7(5-6-10)8(9)11(2,3)4/h10H,5-6H2,1-4H3/b8-7+.
What are the key properties of (Z)-4-iodo-3-methyl-4-trimethylsilylbut-3-en-1-ol?
(Z)-4-iodo-3-methyl-4-trimethylsilylbut-3-en-1-ol has a molecular weight of 284.21 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-iodo-3-methyl-4-trimethylsilylbut-3-en-1-ol is sourced from PubChem (CID 10660677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).