(Z)-2-iodohept-2-ene

C7H13I — CID 13268578

IUPAC(Z)-2-iodohept-2-ene
SMILESCCCC/C=C(/C)I
InChIInChI=1S/C7H13I/c1-3-4-5-6-7(2)8/h6H,3-5H2,1-2H3/b7-6-
InChIKeyNZUQRWCYAIIDBG-SREVYHEPSA-N
MW224.08 g/mol
LogP3.52
Rot. Bonds3

About (Z)-2-iodohept-2-ene

(Z)-2-iodohept-2-ene (PubChem CID 13268578) has the molecular formula C7H13I and a molecular weight of 224.08 g/mol. Its IUPAC name is (Z)-2-iodohept-2-ene.

Molecular Properties

Compound Name(Z)-2-iodohept-2-ene
PubChem CID13268578
Molecular FormulaC7H13I
Molecular Weight224.08 g/mol
Exact Mass224.01
IUPAC Name(Z)-2-iodohept-2-ene
SMILESCCCC/C=C(/C)I
InChIInChI=1S/C7H13I/c1-3-4-5-6-7(2)8/h6H,3-5H2,1-2H3/b7-6-
InChIKeyNZUQRWCYAIIDBG-SREVYHEPSA-N
XLogP3.52
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.08
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-iodohept-2-ene?
The IUPAC name of (Z)-2-iodohept-2-ene (CID 13268578) is (Z)-2-iodohept-2-ene.
What is the SMILES notation for (Z)-2-iodohept-2-ene?
The canonical SMILES for (Z)-2-iodohept-2-ene is CCCC/C=C(/C)I.
What is the InChIKey of (Z)-2-iodohept-2-ene?
The InChIKey is NZUQRWCYAIIDBG-SREVYHEPSA-N. The full InChI is InChI=1S/C7H13I/c1-3-4-5-6-7(2)8/h6H,3-5H2,1-2H3/b7-6-.
What are the key properties of (Z)-2-iodohept-2-ene?
(Z)-2-iodohept-2-ene has a molecular weight of 224.08 g/mol, XLogP of 3.52, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-iodohept-2-ene is sourced from PubChem (CID 13268578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).