1-(3-hydroxypropyl)-2-phosphanyloxycyclopentan-1-ol

C8H17O3P — CID 58779204

IUPAC1-(3-hydroxypropyl)-2-phosphanyloxycyclopentan-1-ol
SMILESOCCCC1(O)CCCC1OP
InChIInChI=1S/C8H17O3P/c9-6-2-5-8(10)4-1-3-7(8)11-12/h7,9-10H,1-6,12H2
InChIKeyIHOYFVKTGQYTMT-UHFFFAOYSA-N
MW192.19 g/mol
LogP0.85
Rot. Bonds4

About 1-(3-hydroxypropyl)-2-phosphanyloxycyclopentan-1-ol

1-(3-hydroxypropyl)-2-phosphanyloxycyclopentan-1-ol (PubChem CID 58779204) has the molecular formula C8H17O3P and a molecular weight of 192.19 g/mol. Its IUPAC name is 1-(3-hydroxypropyl)-2-phosphanyloxycyclopentan-1-ol.

Molecular Properties

Compound Name1-(3-hydroxypropyl)-2-phosphanyloxycyclopentan-1-ol
PubChem CID58779204
Molecular FormulaC8H17O3P
Molecular Weight192.19 g/mol
Exact Mass192.09
IUPAC Name1-(3-hydroxypropyl)-2-phosphanyloxycyclopentan-1-ol
SMILESOCCCC1(O)CCCC1OP
InChIInChI=1S/C8H17O3P/c9-6-2-5-8(10)4-1-3-7(8)11-12/h7,9-10H,1-6,12H2
InChIKeyIHOYFVKTGQYTMT-UHFFFAOYSA-N
XLogP0.85
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.19
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(3-hydroxypropyl)-2-phosphanyloxycyclopentan-1-ol?
The IUPAC name of 1-(3-hydroxypropyl)-2-phosphanyloxycyclopentan-1-ol (CID 58779204) is 1-(3-hydroxypropyl)-2-phosphanyloxycyclopentan-1-ol.
What is the SMILES notation for 1-(3-hydroxypropyl)-2-phosphanyloxycyclopentan-1-ol?
The canonical SMILES for 1-(3-hydroxypropyl)-2-phosphanyloxycyclopentan-1-ol is OCCCC1(O)CCCC1OP.
What is the InChIKey of 1-(3-hydroxypropyl)-2-phosphanyloxycyclopentan-1-ol?
The InChIKey is IHOYFVKTGQYTMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17O3P/c9-6-2-5-8(10)4-1-3-7(8)11-12/h7,9-10H,1-6,12H2.
What are the key properties of 1-(3-hydroxypropyl)-2-phosphanyloxycyclopentan-1-ol?
1-(3-hydroxypropyl)-2-phosphanyloxycyclopentan-1-ol has a molecular weight of 192.19 g/mol, XLogP of 0.85, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-hydroxypropyl)-2-phosphanyloxycyclopentan-1-ol is sourced from PubChem (CID 58779204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).