(4R)-4-(iodomethyl)cyclohexene

C7H11I — CID 11770032

IUPAC(4R)-4-(iodomethyl)cyclohexene
SMILESIC[C@H]1CC=CCC1
InChIInChI=1S/C7H11I/c8-6-7-4-2-1-3-5-7/h1-2,7H,3-6H2/t7-/m0/s1
InChIKeyLYLXVPAPVDFINI-ZETCQYMHSA-N
MW222.07 g/mol
LogP2.78
Rot. Bonds1

About (4R)-4-(iodomethyl)cyclohexene

(4R)-4-(iodomethyl)cyclohexene (PubChem CID 11770032) has the molecular formula C7H11I and a molecular weight of 222.07 g/mol. Its IUPAC name is (4R)-4-(iodomethyl)cyclohexene.

Molecular Properties

Compound Name(4R)-4-(iodomethyl)cyclohexene
PubChem CID11770032
Molecular FormulaC7H11I
Molecular Weight222.07 g/mol
Exact Mass221.99
IUPAC Name(4R)-4-(iodomethyl)cyclohexene
SMILESIC[C@H]1CC=CCC1
InChIInChI=1S/C7H11I/c8-6-7-4-2-1-3-5-7/h1-2,7H,3-6H2/t7-/m0/s1
InChIKeyLYLXVPAPVDFINI-ZETCQYMHSA-N
XLogP2.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.07
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

4-propylcyclohexene
CID 518777
(4R)-4-(methoxymethyl)cyclohexene
CID 124567710
1-cyclohex-3-en-1-yl-N,N-dimethylmethanamine;ethane
CID 177009709
2-(cyclohex-3-en-1-ylmethyl)aziridine
CID 89298763
3-cyclohex-3-en-1-ylpropane-1,1-diol
CID 89285958
cyclohex-3-en-1-ylmethyl nitrite
CID 131854414
cyclohex-3-en-1-ylmethoxy(trimethyl)silane
CID 11084547
4-tetradecylcyclohexene
CID 54499913
4-[(E)-pent-2-enyl]cyclohexene
CID 91748880
N-(cyclohex-3-en-1-ylmethyl)-1-cyclohexylmethanamine
CID 43215811
N-(cyclohex-3-en-1-ylmethyl)cyclododecanamine
CID 63478638
2-[cyclohex-3-en-1-ylmethyl(2-hydroxyethyl)amino]ethanol
CID 2846062

Frequently Asked Questions

What is the IUPAC name of (4R)-4-(iodomethyl)cyclohexene?
The IUPAC name of (4R)-4-(iodomethyl)cyclohexene (CID 11770032) is (4R)-4-(iodomethyl)cyclohexene.
What is the SMILES notation for (4R)-4-(iodomethyl)cyclohexene?
The canonical SMILES for (4R)-4-(iodomethyl)cyclohexene is IC[C@H]1CC=CCC1.
What is the InChIKey of (4R)-4-(iodomethyl)cyclohexene?
The InChIKey is LYLXVPAPVDFINI-ZETCQYMHSA-N. The full InChI is InChI=1S/C7H11I/c8-6-7-4-2-1-3-5-7/h1-2,7H,3-6H2/t7-/m0/s1.
What are the key properties of (4R)-4-(iodomethyl)cyclohexene?
(4R)-4-(iodomethyl)cyclohexene has a molecular weight of 222.07 g/mol, XLogP of 2.78, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-(iodomethyl)cyclohexene is sourced from PubChem (CID 11770032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).