gold;tributylphosphane

C12H27AuP — CID 88800341

IUPACgold;tributylphosphane
SMILESCCCCP(CCCC)CCCC.[Au]
InChIInChI=1S/C12H27P.Au/c1-4-7-10-13(11-8-5-2)12-9-6-3;/h4-12H2,1-3H3;
InChIKeyQMQKUTDACMXYEJ-UHFFFAOYSA-N
MW399.29 g/mol
LogP4.87
Rot. Bonds9

About gold;tributylphosphane

gold;tributylphosphane (PubChem CID 88800341) has the molecular formula C12H27AuP and a molecular weight of 399.29 g/mol. Its IUPAC name is gold;tributylphosphane.

Molecular Properties

Compound Namegold;tributylphosphane
PubChem CID88800341
Molecular FormulaC12H27AuP
Molecular Weight399.29 g/mol
Exact Mass399.15
IUPAC Namegold;tributylphosphane
SMILESCCCCP(CCCC)CCCC.[Au]
InChIInChI=1S/C12H27P.Au/c1-4-7-10-13(11-8-5-2)12-9-6-3;/h4-12H2,1-3H3;
InChIKeyQMQKUTDACMXYEJ-UHFFFAOYSA-N
XLogP4.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.29
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

azane;tributylphosphane
CID 87538509
ruthenium;tetrakis(tributylphosphane)
CID 137286049
nickel;bis(tributylphosphane)
CID 50940317
nickel(2+);tributylphosphane
CID 161451777
dibutyl(5-dibutylphosphanylpentyl)phosphane
CID 90109453
cobalt;rhodium;tributylphosphane
CID 174653599
platinum;bis(tributylphosphane);dihydrochloride
CID 101088975
dibutyl(tetradecyl)phosphane
CID 118319275
dibutyl(decyl)phosphane
CID 171559269
tripentylphosphane
CID 2784073
tributylphosphane;trichlorocobalt
CID 174913282
chloroform;tributylphosphane
CID 87403775

Frequently Asked Questions

What is the IUPAC name of gold;tributylphosphane?
The IUPAC name of gold;tributylphosphane (CID 88800341) is gold;tributylphosphane.
What is the SMILES notation for gold;tributylphosphane?
The canonical SMILES for gold;tributylphosphane is CCCCP(CCCC)CCCC.[Au].
What is the InChIKey of gold;tributylphosphane?
The InChIKey is QMQKUTDACMXYEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27P.Au/c1-4-7-10-13(11-8-5-2)12-9-6-3;/h4-12H2,1-3H3;.
What are the key properties of gold;tributylphosphane?
gold;tributylphosphane has a molecular weight of 399.29 g/mol, XLogP of 4.87, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for gold;tributylphosphane is sourced from PubChem (CID 88800341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).