5-iodophosphanyloxypentan-1-ol

C5H12IO2P — CID 126669249

IUPAC5-iodophosphanyloxypentan-1-ol
SMILESOCCCCCOPI
InChIInChI=1S/C5H12IO2P/c6-9-8-5-3-1-2-4-7/h7,9H,1-5H2
InChIKeySQYWRWLXLPUOEP-UHFFFAOYSA-N
MW262.03 g/mol
LogP2.11
Rot. Bonds6

About 5-iodophosphanyloxypentan-1-ol

5-iodophosphanyloxypentan-1-ol (PubChem CID 126669249) has the molecular formula C5H12IO2P and a molecular weight of 262.03 g/mol. Its IUPAC name is 5-iodophosphanyloxypentan-1-ol.

Molecular Properties

Compound Name5-iodophosphanyloxypentan-1-ol
PubChem CID126669249
Molecular FormulaC5H12IO2P
Molecular Weight262.03 g/mol
Exact Mass261.96
IUPAC Name5-iodophosphanyloxypentan-1-ol
SMILESOCCCCCOPI
InChIInChI=1S/C5H12IO2P/c6-9-8-5-3-1-2-4-7/h7,9H,1-5H2
InChIKeySQYWRWLXLPUOEP-UHFFFAOYSA-N
XLogP2.11
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.03
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-iodophosphanyloxypentan-1-ol?
The IUPAC name of 5-iodophosphanyloxypentan-1-ol (CID 126669249) is 5-iodophosphanyloxypentan-1-ol.
What is the SMILES notation for 5-iodophosphanyloxypentan-1-ol?
The canonical SMILES for 5-iodophosphanyloxypentan-1-ol is OCCCCCOPI.
What is the InChIKey of 5-iodophosphanyloxypentan-1-ol?
The InChIKey is SQYWRWLXLPUOEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12IO2P/c6-9-8-5-3-1-2-4-7/h7,9H,1-5H2.
What are the key properties of 5-iodophosphanyloxypentan-1-ol?
5-iodophosphanyloxypentan-1-ol has a molecular weight of 262.03 g/mol, XLogP of 2.11, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-iodophosphanyloxypentan-1-ol is sourced from PubChem (CID 126669249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).