gold(1+);octadecanoate

C18H35AuO2 — CID 23509280

IUPACgold(1+);octadecanoate
SMILESCCCCCCCCCCCCCCCCCC(=O)[O-].[Au+]
InChIInChI=1S/C18H36O2.Au/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;/h2-17H2,1H3,(H,19,20);/q;+1/p-1
InChIKeyNMFDLALBIQJQDX-UHFFFAOYSA-M
MW480.44 g/mol
LogP5.00
Rot. Bonds16

About gold(1+);octadecanoate

gold(1+);octadecanoate (PubChem CID 23509280) has the molecular formula C18H35AuO2 and a molecular weight of 480.44 g/mol. Its IUPAC name is gold(1+);octadecanoate.

Molecular Properties

Compound Namegold(1+);octadecanoate
PubChem CID23509280
Molecular FormulaC18H35AuO2
Molecular Weight480.44 g/mol
Exact Mass480.23
IUPAC Namegold(1+);octadecanoate
SMILESCCCCCCCCCCCCCCCCCC(=O)[O-].[Au+]
InChIInChI=1S/C18H36O2.Au/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;/h2-17H2,1H3,(H,19,20);/q;+1/p-1
InChIKeyNMFDLALBIQJQDX-UHFFFAOYSA-M
XLogP5.00
TPSA40.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds16
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500480.44
LogP ≤ 55.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

CID 23623890
CID 23623890
octadecanoate
CID 3033836
bis(octadecanoate);platinum(2+)
CID 87233709
aluminum tris(dodecanoate)
CID 18764696
tripotassium;dodecanoate;hexadecanoate;tetradecanoate
CID 161147915
calcium;hexadecanoate;octadecanoate
CID 22065418
decanoate;lanthanum(3+)
CID 21139452
dimagnesium;octadecanoate
CID 19105820
magnesium;docosanoate;octadecanoate
CID 158868243
bis(undecanoate);zirconium(2+)
CID 18995554
manganese(2+);bis(tricosanoate)
CID 100951425
tetrakis(octadecanoate);thorium(4+)
CID 160802738

Frequently Asked Questions

What is the IUPAC name of gold(1+);octadecanoate?
The IUPAC name of gold(1+);octadecanoate (CID 23509280) is gold(1+);octadecanoate.
What is the SMILES notation for gold(1+);octadecanoate?
The canonical SMILES for gold(1+);octadecanoate is CCCCCCCCCCCCCCCCCC(=O)[O-].[Au+].
What is the InChIKey of gold(1+);octadecanoate?
The InChIKey is NMFDLALBIQJQDX-UHFFFAOYSA-M. The full InChI is InChI=1S/C18H36O2.Au/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;/h2-17H2,1H3,(H,19,20);/q;+1/p-1.
What are the key properties of gold(1+);octadecanoate?
gold(1+);octadecanoate has a molecular weight of 480.44 g/mol, XLogP of 5.00, 16 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for gold(1+);octadecanoate is sourced from PubChem (CID 23509280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).