(1-propan-2-ylcyclohexyl) hypoiodite

C9H17IO — CID 166941046

IUPAC(1-propan-2-ylcyclohexyl) hypoiodite
SMILESCC(C)C1(OI)CCCCC1
InChIInChI=1S/C9H17IO/c1-8(2)9(11-10)6-4-3-5-7-9/h8H,3-7H2,1-2H3
InChIKeyZWDZISBVUHNTMA-UHFFFAOYSA-N
MW268.14 g/mol
LogP3.71
Rot. Bonds2

About (1-propan-2-ylcyclohexyl) hypoiodite

(1-propan-2-ylcyclohexyl) hypoiodite (PubChem CID 166941046) has the molecular formula C9H17IO and a molecular weight of 268.14 g/mol. Its IUPAC name is (1-propan-2-ylcyclohexyl) hypoiodite.

Molecular Properties

Compound Name(1-propan-2-ylcyclohexyl) hypoiodite
PubChem CID166941046
Molecular FormulaC9H17IO
Molecular Weight268.14 g/mol
Exact Mass268.03
IUPAC Name(1-propan-2-ylcyclohexyl) hypoiodite
SMILESCC(C)C1(OI)CCCCC1
InChIInChI=1S/C9H17IO/c1-8(2)9(11-10)6-4-3-5-7-9/h8H,3-7H2,1-2H3
InChIKeyZWDZISBVUHNTMA-UHFFFAOYSA-N
XLogP3.71
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.14
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1-propan-2-ylcyclohexyl) hypoiodite?
The IUPAC name of (1-propan-2-ylcyclohexyl) hypoiodite (CID 166941046) is (1-propan-2-ylcyclohexyl) hypoiodite.
What is the SMILES notation for (1-propan-2-ylcyclohexyl) hypoiodite?
The canonical SMILES for (1-propan-2-ylcyclohexyl) hypoiodite is CC(C)C1(OI)CCCCC1.
What is the InChIKey of (1-propan-2-ylcyclohexyl) hypoiodite?
The InChIKey is ZWDZISBVUHNTMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17IO/c1-8(2)9(11-10)6-4-3-5-7-9/h8H,3-7H2,1-2H3.
What are the key properties of (1-propan-2-ylcyclohexyl) hypoiodite?
(1-propan-2-ylcyclohexyl) hypoiodite has a molecular weight of 268.14 g/mol, XLogP of 3.71, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-propan-2-ylcyclohexyl) hypoiodite is sourced from PubChem (CID 166941046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).