2-iodohex-1-ene

C6H11I — CID 543532

IUPAC2-iodohex-1-ene
SMILESC=C(I)CCCC
InChIInChI=1S/C6H11I/c1-3-4-5-6(2)7/h2-5H2,1H3
InChIKeyHXHBSEFLWXXWSX-UHFFFAOYSA-N
MW210.06 g/mol
LogP3.13
Rot. Bonds3

About 2-iodohex-1-ene

2-iodohex-1-ene (PubChem CID 543532) has the molecular formula C6H11I and a molecular weight of 210.06 g/mol. Its IUPAC name is 2-iodohex-1-ene.

Molecular Properties

Compound Name2-iodohex-1-ene
PubChem CID543532
Molecular FormulaC6H11I
Molecular Weight210.06 g/mol
Exact Mass209.99
IUPAC Name2-iodohex-1-ene
SMILESC=C(I)CCCC
InChIInChI=1S/C6H11I/c1-3-4-5-6(2)7/h2-5H2,1H3
InChIKeyHXHBSEFLWXXWSX-UHFFFAOYSA-N
XLogP3.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.06
LogP ≤ 53.13
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

trans-1-Iodo-1-hexene
CID 5362933
6-Iodo-1-hexene
CID 10878409
4-Iodopent-1-ene
CID 13244562
1-Hexene, 1-iodo-, (Z)-
CID 5362694
(Z)-1-iodo-1-heptene
CID 10966141
(1E)-1-Iodohept-1-ene
CID 11096220
cis-1-Iodo-1-pentene
CID 11116953
(E)-1-iodo-1-pentene
CID 12173745
2-Iodobutene
CID 14042947
3-Iodo-1-pentene
CID 54238517
1-Hexene, 5-iodo-
CID 11252794
6-Iodo-1-heptene
CID 13296843

Frequently Asked Questions

What is the IUPAC name of 2-iodohex-1-ene?
The IUPAC name of 2-iodohex-1-ene (CID 543532) is 2-iodohex-1-ene.
What is the SMILES notation for 2-iodohex-1-ene?
The canonical SMILES for 2-iodohex-1-ene is C=C(I)CCCC.
What is the InChIKey of 2-iodohex-1-ene?
The InChIKey is HXHBSEFLWXXWSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11I/c1-3-4-5-6(2)7/h2-5H2,1H3.
What are the key properties of 2-iodohex-1-ene?
2-iodohex-1-ene has a molecular weight of 210.06 g/mol, XLogP of 3.13, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-iodohex-1-ene is sourced from PubChem (CID 543532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).