triethyl(2-hydroxypropan-2-yl)phosphanium

C9H22OP+ — CID 102268040

IUPACtriethyl(2-hydroxypropan-2-yl)phosphanium
SMILESCC[P+](CC)(CC)C(C)(C)O
InChIInChI=1S/C9H22OP/c1-6-11(7-2,8-3)9(4,5)10/h10H,6-8H2,1-5H3/q+1
InChIKeyBQCVTQQYXWKVRD-UHFFFAOYSA-N
MW177.25 g/mol
LogP2.79
Rot. Bonds4

About triethyl(2-hydroxypropan-2-yl)phosphanium

triethyl(2-hydroxypropan-2-yl)phosphanium (PubChem CID 102268040) has the molecular formula C9H22OP+ and a molecular weight of 177.25 g/mol. Its IUPAC name is triethyl(2-hydroxypropan-2-yl)phosphanium.

Molecular Properties

Compound Nametriethyl(2-hydroxypropan-2-yl)phosphanium
PubChem CID102268040
Molecular FormulaC9H22OP+
Molecular Weight177.25 g/mol
Exact Mass177.14
IUPAC Nametriethyl(2-hydroxypropan-2-yl)phosphanium
SMILESCC[P+](CC)(CC)C(C)(C)O
InChIInChI=1S/C9H22OP/c1-6-11(7-2,8-3)9(4,5)10/h10H,6-8H2,1-5H3/q+1
InChIKeyBQCVTQQYXWKVRD-UHFFFAOYSA-N
XLogP2.79
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

butane;propane-2,2-diol
CID 142587058
(3R,4R)-2,2,3,4-tetramethylhexan-3-ol
CID 170849873
3-ethyl-1,1,1-trifluoro-2-(trifluoromethyl)pentan-2-ol
CID 137421832
2-(pentan-3-ylamino)propan-2-ol
CID 173163807
2,3,4-trimethylhexane-2,3-diol
CID 12714107
(E,3R)-2,3,6-trimethyloct-4-en-2-ol
CID 90299782
2,2-diamino-4-ethyl-3-methylhexan-3-ol
CID 154164458
4-amino-5,5-dimethylhexan-3-ol
CID 164650293
2,8-dimethyldecan-2-ol
CID 122367233
(4E)-3,6-dimethylocta-1,4-dien-3-ol
CID 20526736
ethanol;methanol;2-methylpropan-2-ol;propan-2-ol
CID 157184290
4-ethyl-5-hydroxy-2,2,5-trimethylhexan-3-one
CID 131848438

Frequently Asked Questions

What is the IUPAC name of triethyl(2-hydroxypropan-2-yl)phosphanium?
The IUPAC name of triethyl(2-hydroxypropan-2-yl)phosphanium (CID 102268040) is triethyl(2-hydroxypropan-2-yl)phosphanium.
What is the SMILES notation for triethyl(2-hydroxypropan-2-yl)phosphanium?
The canonical SMILES for triethyl(2-hydroxypropan-2-yl)phosphanium is CC[P+](CC)(CC)C(C)(C)O.
What is the InChIKey of triethyl(2-hydroxypropan-2-yl)phosphanium?
The InChIKey is BQCVTQQYXWKVRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22OP/c1-6-11(7-2,8-3)9(4,5)10/h10H,6-8H2,1-5H3/q+1.
What are the key properties of triethyl(2-hydroxypropan-2-yl)phosphanium?
triethyl(2-hydroxypropan-2-yl)phosphanium has a molecular weight of 177.25 g/mol, XLogP of 2.79, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl(2-hydroxypropan-2-yl)phosphanium is sourced from PubChem (CID 102268040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).