(E)-1-iodo-4-methylpent-1-ene

C6H11I — CID 11447141

IUPAC(E)-1-iodo-4-methylpent-1-ene
SMILESCC(C)C/C=C/I
InChIInChI=1S/C6H11I/c1-6(2)4-3-5-7/h3,5-6H,4H2,1-2H3/b5-3+
InChIKeyCAUHHKNNYZKYPC-HWKANZROSA-N
MW210.06 g/mol
LogP2.98
Rot. Bonds2

About (E)-1-iodo-4-methylpent-1-ene

(E)-1-iodo-4-methylpent-1-ene (PubChem CID 11447141) has the molecular formula C6H11I and a molecular weight of 210.06 g/mol. Its IUPAC name is (E)-1-iodo-4-methylpent-1-ene.

Molecular Properties

Compound Name(E)-1-iodo-4-methylpent-1-ene
PubChem CID11447141
Molecular FormulaC6H11I
Molecular Weight210.06 g/mol
Exact Mass209.99
IUPAC Name(E)-1-iodo-4-methylpent-1-ene
SMILESCC(C)C/C=C/I
InChIInChI=1S/C6H11I/c1-6(2)4-3-5-7/h3,5-6H,4H2,1-2H3/b5-3+
InChIKeyCAUHHKNNYZKYPC-HWKANZROSA-N
XLogP2.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.06
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (E)-1-iodo-4-methylpent-1-ene?
The IUPAC name of (E)-1-iodo-4-methylpent-1-ene (CID 11447141) is (E)-1-iodo-4-methylpent-1-ene.
What is the SMILES notation for (E)-1-iodo-4-methylpent-1-ene?
The canonical SMILES for (E)-1-iodo-4-methylpent-1-ene is CC(C)C/C=C/I.
What is the InChIKey of (E)-1-iodo-4-methylpent-1-ene?
The InChIKey is CAUHHKNNYZKYPC-HWKANZROSA-N. The full InChI is InChI=1S/C6H11I/c1-6(2)4-3-5-7/h3,5-6H,4H2,1-2H3/b5-3+.
What are the key properties of (E)-1-iodo-4-methylpent-1-ene?
(E)-1-iodo-4-methylpent-1-ene has a molecular weight of 210.06 g/mol, XLogP of 2.98, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-iodo-4-methylpent-1-ene is sourced from PubChem (CID 11447141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).