trihydroxy-di(propan-2-yl)-λ5-phosphane

C6H17O3P — CID 57021697

IUPACtrihydroxy-di(propan-2-yl)-λ5-phosphane
SMILESCC(C)P(O)(O)(O)C(C)C
InChIInChI=1S/C6H17O3P/c1-5(2)10(7,8,9)6(3)4/h5-9H,1-4H3
InChIKeySZIVKFZLMNJHDE-UHFFFAOYSA-N
MW168.17 g/mol
LogP1.08
Rot. Bonds2

About trihydroxy-di(propan-2-yl)-λ5-phosphane

trihydroxy-di(propan-2-yl)-λ5-phosphane (PubChem CID 57021697) has the molecular formula C6H17O3P and a molecular weight of 168.17 g/mol. Its IUPAC name is trihydroxy-di(propan-2-yl)-λ5-phosphane.

Molecular Properties

Compound Nametrihydroxy-di(propan-2-yl)-λ5-phosphane
PubChem CID57021697
Molecular FormulaC6H17O3P
Molecular Weight168.17 g/mol
Exact Mass168.09
IUPAC Nametrihydroxy-di(propan-2-yl)-λ5-phosphane
SMILESCC(C)P(O)(O)(O)C(C)C
InChIInChI=1S/C6H17O3P/c1-5(2)10(7,8,9)6(3)4/h5-9H,1-4H3
InChIKeySZIVKFZLMNJHDE-UHFFFAOYSA-N
XLogP1.08
TPSA60.69 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.17
LogP ≤ 51.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

P,P-Dibutylphosphinic acid
CID 97031
Butyl-phosphonothioic acid
CID 20262261
Dipropylphosphinic acid
CID 9124933
Methyl(propan-2-yl)phosphinic acid
CID 14440203
Tributylphosphonium hydroxide
CID 6396054
Phosphinous acid, dibutyl-
CID 11686957
Butylphosphonous acid
CID 13783034
Diisopropylphosphinic acid
CID 14934127
Butylphosphorous acid
CID 21448879
Diethylphosphorous acid
CID 53629749
Diisobutylphosphorous acid
CID 57009988
Dipropylphosphorous acid
CID 57010229

Frequently Asked Questions

What is the IUPAC name of trihydroxy-di(propan-2-yl)-λ5-phosphane?
The IUPAC name of trihydroxy-di(propan-2-yl)-λ5-phosphane (CID 57021697) is trihydroxy-di(propan-2-yl)-λ5-phosphane.
What is the SMILES notation for trihydroxy-di(propan-2-yl)-λ5-phosphane?
The canonical SMILES for trihydroxy-di(propan-2-yl)-λ5-phosphane is CC(C)P(O)(O)(O)C(C)C.
What is the InChIKey of trihydroxy-di(propan-2-yl)-λ5-phosphane?
The InChIKey is SZIVKFZLMNJHDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H17O3P/c1-5(2)10(7,8,9)6(3)4/h5-9H,1-4H3.
What are the key properties of trihydroxy-di(propan-2-yl)-λ5-phosphane?
trihydroxy-di(propan-2-yl)-λ5-phosphane has a molecular weight of 168.17 g/mol, XLogP of 1.08, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trihydroxy-di(propan-2-yl)-λ5-phosphane is sourced from PubChem (CID 57021697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).