hydroxy-trimethyl-propyl-λ5-phosphane

C6H17OP — CID 140644824

IUPAChydroxy-trimethyl-propyl-λ5-phosphane
SMILESCCCP(C)(C)(C)O
InChIInChI=1S/C6H17OP/c1-5-6-8(2,3,4)7/h7H,5-6H2,1-4H3
InChIKeyIJXGTYZBROTOOU-UHFFFAOYSA-N
MW136.18 g/mol
LogP1.75
Rot. Bonds2

About hydroxy-trimethyl-propyl-λ5-phosphane

hydroxy-trimethyl-propyl-λ5-phosphane (PubChem CID 140644824) has the molecular formula C6H17OP and a molecular weight of 136.18 g/mol. Its IUPAC name is hydroxy-trimethyl-propyl-λ5-phosphane.

Molecular Properties

Compound Namehydroxy-trimethyl-propyl-λ5-phosphane
PubChem CID140644824
Molecular FormulaC6H17OP
Molecular Weight136.18 g/mol
Exact Mass136.10
IUPAC Namehydroxy-trimethyl-propyl-λ5-phosphane
SMILESCCCP(C)(C)(C)O
InChIInChI=1S/C6H17OP/c1-5-6-8(2,3,4)7/h7H,5-6H2,1-4H3
InChIKeyIJXGTYZBROTOOU-UHFFFAOYSA-N
XLogP1.75
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.18
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of hydroxy-trimethyl-propyl-λ5-phosphane?
The IUPAC name of hydroxy-trimethyl-propyl-λ5-phosphane (CID 140644824) is hydroxy-trimethyl-propyl-λ5-phosphane.
What is the SMILES notation for hydroxy-trimethyl-propyl-λ5-phosphane?
The canonical SMILES for hydroxy-trimethyl-propyl-λ5-phosphane is CCCP(C)(C)(C)O.
What is the InChIKey of hydroxy-trimethyl-propyl-λ5-phosphane?
The InChIKey is IJXGTYZBROTOOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H17OP/c1-5-6-8(2,3,4)7/h7H,5-6H2,1-4H3.
What are the key properties of hydroxy-trimethyl-propyl-λ5-phosphane?
hydroxy-trimethyl-propyl-λ5-phosphane has a molecular weight of 136.18 g/mol, XLogP of 1.75, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-trimethyl-propyl-λ5-phosphane is sourced from PubChem (CID 140644824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).