(E)-3,4-diiodohex-3-ene

C6H10I2 — CID 12616830

IUPAC(E)-3,4-diiodohex-3-ene
SMILESCC/C(I)=C(\I)CC
InChIInChI=1S/C6H10I2/c1-3-5(7)6(8)4-2/h3-4H2,1-2H3/b6-5+
InChIKeyHPDKMUZNNINYTB-AATRIKPKSA-N
MW335.95 g/mol
LogP3.89
Rot. Bonds2

About (E)-3,4-diiodohex-3-ene

(E)-3,4-diiodohex-3-ene (PubChem CID 12616830) has the molecular formula C6H10I2 and a molecular weight of 335.95 g/mol. Its IUPAC name is (E)-3,4-diiodohex-3-ene.

Molecular Properties

Compound Name(E)-3,4-diiodohex-3-ene
PubChem CID12616830
Molecular FormulaC6H10I2
Molecular Weight335.95 g/mol
Exact Mass335.89
IUPAC Name(E)-3,4-diiodohex-3-ene
SMILESCC/C(I)=C(\I)CC
InChIInChI=1S/C6H10I2/c1-3-5(7)6(8)4-2/h3-4H2,1-2H3/b6-5+
InChIKeyHPDKMUZNNINYTB-AATRIKPKSA-N
XLogP3.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.95
LogP ≤ 53.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(E)-4,5-diiodooct-4-ene
CID 10618736
(Z)-1,3-diiodopent-2-ene
CID 59097701
(E)-3-fluoro-4-iodohex-3-ene
CID 12545933
[(Z)-2-fluoropent-2-en-3-yl]-methylidene-lambda3-iodane
CID 163746619
(E)-2,3-diiodopent-2-ene
CID 23650030
(E)-2,3-diiodohex-2-ene
CID 23650031
3-Fluoro-4-iodohex-3-ene
CID 85441116
2,5-Diiodo-pent-2-ene
CID 5375401
5-Iodo-2,3-dimethylpent-2-ene
CID 10537081
1,3-Diiodopent-2-ene
CID 72515963
2,3-Diiodohex-2-ene
CID 74078671
(E)-1,2-diiodopent-2-ene
CID 118516393

Frequently Asked Questions

What is the IUPAC name of (E)-3,4-diiodohex-3-ene?
The IUPAC name of (E)-3,4-diiodohex-3-ene (CID 12616830) is (E)-3,4-diiodohex-3-ene.
What is the SMILES notation for (E)-3,4-diiodohex-3-ene?
The canonical SMILES for (E)-3,4-diiodohex-3-ene is CC/C(I)=C(\I)CC.
What is the InChIKey of (E)-3,4-diiodohex-3-ene?
The InChIKey is HPDKMUZNNINYTB-AATRIKPKSA-N. The full InChI is InChI=1S/C6H10I2/c1-3-5(7)6(8)4-2/h3-4H2,1-2H3/b6-5+.
What are the key properties of (E)-3,4-diiodohex-3-ene?
(E)-3,4-diiodohex-3-ene has a molecular weight of 335.95 g/mol, XLogP of 3.89, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3,4-diiodohex-3-ene is sourced from PubChem (CID 12616830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).