trihydroxy-bis(2-methylpropyl)-λ5-phosphane

C8H21O3P — CID 57009988

IUPACtrihydroxy-bis(2-methylpropyl)-λ5-phosphane
SMILESCC(C)CP(O)(O)(O)CC(C)C
InChIInChI=1S/C8H21O3P/c1-7(2)5-12(9,10,11)6-8(3)4/h7-11H,5-6H2,1-4H3
InChIKeyWUHCJANXMTUWBY-UHFFFAOYSA-N
MW196.23 g/mol
LogP1.57
Rot. Bonds4

About trihydroxy-bis(2-methylpropyl)-λ5-phosphane

trihydroxy-bis(2-methylpropyl)-λ5-phosphane (PubChem CID 57009988) has the molecular formula C8H21O3P and a molecular weight of 196.23 g/mol. Its IUPAC name is trihydroxy-bis(2-methylpropyl)-λ5-phosphane.

Molecular Properties

Compound Nametrihydroxy-bis(2-methylpropyl)-λ5-phosphane
PubChem CID57009988
Molecular FormulaC8H21O3P
Molecular Weight196.23 g/mol
Exact Mass196.12
IUPAC Nametrihydroxy-bis(2-methylpropyl)-λ5-phosphane
SMILESCC(C)CP(O)(O)(O)CC(C)C
InChIInChI=1S/C8H21O3P/c1-7(2)5-12(9,10,11)6-8(3)4/h7-11H,5-6H2,1-4H3
InChIKeyWUHCJANXMTUWBY-UHFFFAOYSA-N
XLogP1.57
TPSA60.69 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.23
LogP ≤ 51.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze trihydroxy-bis(2-methylpropyl)-λ5-phosphane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of trihydroxy-bis(2-methylpropyl)-λ5-phosphane?
The IUPAC name of trihydroxy-bis(2-methylpropyl)-λ5-phosphane (CID 57009988) is trihydroxy-bis(2-methylpropyl)-λ5-phosphane.
What is the SMILES notation for trihydroxy-bis(2-methylpropyl)-λ5-phosphane?
The canonical SMILES for trihydroxy-bis(2-methylpropyl)-λ5-phosphane is CC(C)CP(O)(O)(O)CC(C)C.
What is the InChIKey of trihydroxy-bis(2-methylpropyl)-λ5-phosphane?
The InChIKey is WUHCJANXMTUWBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H21O3P/c1-7(2)5-12(9,10,11)6-8(3)4/h7-11H,5-6H2,1-4H3.
What are the key properties of trihydroxy-bis(2-methylpropyl)-λ5-phosphane?
trihydroxy-bis(2-methylpropyl)-λ5-phosphane has a molecular weight of 196.23 g/mol, XLogP of 1.57, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trihydroxy-bis(2-methylpropyl)-λ5-phosphane is sourced from PubChem (CID 57009988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).