(Z)-5-iodo-4-methyl-5-trimethylsilylpent-4-en-2-ol

C9H19IOSi — CID 10613990

IUPAC(Z)-5-iodo-4-methyl-5-trimethylsilylpent-4-en-2-ol
SMILESC/C(CC(C)O)=C(/I)[Si](C)(C)C
InChIInChI=1S/C9H19IOSi/c1-7(6-8(2)11)9(10)12(3,4)5/h8,11H,6H2,1-5H3/b9-7+
InChIKeyNHDLTWHEZRYHQZ-VQHVLOKHSA-N
MW298.24 g/mol
LogP3.34
Rot. Bonds3

About (Z)-5-iodo-4-methyl-5-trimethylsilylpent-4-en-2-ol

(Z)-5-iodo-4-methyl-5-trimethylsilylpent-4-en-2-ol (PubChem CID 10613990) has the molecular formula C9H19IOSi and a molecular weight of 298.24 g/mol. Its IUPAC name is (Z)-5-iodo-4-methyl-5-trimethylsilylpent-4-en-2-ol.

Molecular Properties

Compound Name(Z)-5-iodo-4-methyl-5-trimethylsilylpent-4-en-2-ol
PubChem CID10613990
Molecular FormulaC9H19IOSi
Molecular Weight298.24 g/mol
Exact Mass298.02
IUPAC Name(Z)-5-iodo-4-methyl-5-trimethylsilylpent-4-en-2-ol
SMILESC/C(CC(C)O)=C(/I)[Si](C)(C)C
InChIInChI=1S/C9H19IOSi/c1-7(6-8(2)11)9(10)12(3,4)5/h8,11H,6H2,1-5H3/b9-7+
InChIKeyNHDLTWHEZRYHQZ-VQHVLOKHSA-N
XLogP3.34
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.24
LogP ≤ 53.34
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)-5-iodo-4-methyl-5-trimethylsilylpent-4-en-2-ol?
The IUPAC name of (Z)-5-iodo-4-methyl-5-trimethylsilylpent-4-en-2-ol (CID 10613990) is (Z)-5-iodo-4-methyl-5-trimethylsilylpent-4-en-2-ol.
What is the SMILES notation for (Z)-5-iodo-4-methyl-5-trimethylsilylpent-4-en-2-ol?
The canonical SMILES for (Z)-5-iodo-4-methyl-5-trimethylsilylpent-4-en-2-ol is C/C(CC(C)O)=C(/I)[Si](C)(C)C.
What is the InChIKey of (Z)-5-iodo-4-methyl-5-trimethylsilylpent-4-en-2-ol?
The InChIKey is NHDLTWHEZRYHQZ-VQHVLOKHSA-N. The full InChI is InChI=1S/C9H19IOSi/c1-7(6-8(2)11)9(10)12(3,4)5/h8,11H,6H2,1-5H3/b9-7+.
What are the key properties of (Z)-5-iodo-4-methyl-5-trimethylsilylpent-4-en-2-ol?
(Z)-5-iodo-4-methyl-5-trimethylsilylpent-4-en-2-ol has a molecular weight of 298.24 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5-iodo-4-methyl-5-trimethylsilylpent-4-en-2-ol is sourced from PubChem (CID 10613990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).