(Z)-5-iodo-4-methylpent-4-en-2-ol

C6H11IO — CID 10585310

IUPAC(Z)-5-iodo-4-methylpent-4-en-2-ol
SMILESC/C(=C/I)CC(C)O
InChIInChI=1S/C6H11IO/c1-5(4-7)3-6(2)8/h4,6,8H,3H2,1-2H3/b5-4-
InChIKeyKRNSYJPONILOPW-PLNGDYQASA-N
MW226.06 g/mol
LogP2.10
Rot. Bonds2

About (Z)-5-iodo-4-methylpent-4-en-2-ol

(Z)-5-iodo-4-methylpent-4-en-2-ol (PubChem CID 10585310) has the molecular formula C6H11IO and a molecular weight of 226.06 g/mol. Its IUPAC name is (Z)-5-iodo-4-methylpent-4-en-2-ol.

Molecular Properties

Compound Name(Z)-5-iodo-4-methylpent-4-en-2-ol
PubChem CID10585310
Molecular FormulaC6H11IO
Molecular Weight226.06 g/mol
Exact Mass225.99
IUPAC Name(Z)-5-iodo-4-methylpent-4-en-2-ol
SMILESC/C(=C/I)CC(C)O
InChIInChI=1S/C6H11IO/c1-5(4-7)3-6(2)8/h4,6,8H,3H2,1-2H3/b5-4-
InChIKeyKRNSYJPONILOPW-PLNGDYQASA-N
XLogP2.10
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.06
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-5-iodo-4-methylpent-4-en-2-ol?
The IUPAC name of (Z)-5-iodo-4-methylpent-4-en-2-ol (CID 10585310) is (Z)-5-iodo-4-methylpent-4-en-2-ol.
What is the SMILES notation for (Z)-5-iodo-4-methylpent-4-en-2-ol?
The canonical SMILES for (Z)-5-iodo-4-methylpent-4-en-2-ol is C/C(=C/I)CC(C)O.
What is the InChIKey of (Z)-5-iodo-4-methylpent-4-en-2-ol?
The InChIKey is KRNSYJPONILOPW-PLNGDYQASA-N. The full InChI is InChI=1S/C6H11IO/c1-5(4-7)3-6(2)8/h4,6,8H,3H2,1-2H3/b5-4-.
What are the key properties of (Z)-5-iodo-4-methylpent-4-en-2-ol?
(Z)-5-iodo-4-methylpent-4-en-2-ol has a molecular weight of 226.06 g/mol, XLogP of 2.10, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5-iodo-4-methylpent-4-en-2-ol is sourced from PubChem (CID 10585310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).