(E)-1-iodobut-1-ene

C4H7I — CID 10986905

IUPAC(E)-1-iodobut-1-ene
SMILESCC/C=C/I
InChIInChI=1S/C4H7I/c1-2-3-4-5/h3-4H,2H2,1H3/b4-3+
InChIKeyUENDJFLKLJJYIK-ONEGZZNKSA-N
MW182.00 g/mol
LogP2.35
Rot. Bonds1

About (E)-1-iodobut-1-ene

(E)-1-iodobut-1-ene (PubChem CID 10986905) has the molecular formula C4H7I and a molecular weight of 182.00 g/mol. Its IUPAC name is (E)-1-iodobut-1-ene.

Molecular Properties

Compound Name(E)-1-iodobut-1-ene
PubChem CID10986905
Molecular FormulaC4H7I
Molecular Weight182.00 g/mol
Exact Mass181.96
IUPAC Name(E)-1-iodobut-1-ene
SMILESCC/C=C/I
InChIInChI=1S/C4H7I/c1-2-3-4-5/h3-4H,2H2,1H3/b4-3+
InChIKeyUENDJFLKLJJYIK-ONEGZZNKSA-N
XLogP2.35
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.00
LogP ≤ 52.35
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

4-Iodobut-1-ene
CID 543216
trans-1-Iodo-1-hexene
CID 5362933
5-Iodopent-1-ene
CID 10987172
1-Iodo-2-butene
CID 6432602
4-Iodopent-1-ene
CID 13244562
1-Hexene, 1-iodo-, (Z)-
CID 5362694
cis-1-Iodo-1-pentene
CID 11116953
1-Iodo-(z)-1-butene
CID 11830050
(E)-1-iodo-1-pentene
CID 12173745
2-Iodobutene
CID 14042947
(E)-1-iodo-3-methylbut-1-ene
CID 14571425
3-Iodo-1-pentene
CID 54238517

Frequently Asked Questions

What is the IUPAC name of (E)-1-iodobut-1-ene?
The IUPAC name of (E)-1-iodobut-1-ene (CID 10986905) is (E)-1-iodobut-1-ene.
What is the SMILES notation for (E)-1-iodobut-1-ene?
The canonical SMILES for (E)-1-iodobut-1-ene is CC/C=C/I.
What is the InChIKey of (E)-1-iodobut-1-ene?
The InChIKey is UENDJFLKLJJYIK-ONEGZZNKSA-N. The full InChI is InChI=1S/C4H7I/c1-2-3-4-5/h3-4H,2H2,1H3/b4-3+.
What are the key properties of (E)-1-iodobut-1-ene?
(E)-1-iodobut-1-ene has a molecular weight of 182.00 g/mol, XLogP of 2.35, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-iodobut-1-ene is sourced from PubChem (CID 10986905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).