antimony(3+);tris(dicyclohexyl phosphite)

C36H66O9P3Sb — CID 23464194

IUPACantimony(3+);tris(dicyclohexyl phosphite)
SMILES[O-]P(OC1CCCCC1)OC1CCCCC1.[O-]P(OC1CCCCC1)OC1CCCCC1.[O-]P(OC1CCCCC1)OC1CCCCC1.[Sb+3]
InChIInChI=1S/3C12H22O3P.Sb/c3*13-16(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12;/h3*11-12H,1-10H2;/q3*-1;+3
InChIKeyTXAPYFIWPVYSEU-UHFFFAOYSA-N
MW857.60 g/mol
LogP9.44
Rot. Bonds12

About antimony(3+);tris(dicyclohexyl phosphite)

antimony(3+);tris(dicyclohexyl phosphite) (PubChem CID 23464194) has the molecular formula C36H66O9P3Sb and a molecular weight of 857.60 g/mol. Its IUPAC name is antimony(3+);tris(dicyclohexyl phosphite).

Molecular Properties

Compound Nameantimony(3+);tris(dicyclohexyl phosphite)
PubChem CID23464194
Molecular FormulaC36H66O9P3Sb
Molecular Weight857.60 g/mol
Exact Mass856.30
IUPAC Nameantimony(3+);tris(dicyclohexyl phosphite)
SMILES[O-]P(OC1CCCCC1)OC1CCCCC1.[O-]P(OC1CCCCC1)OC1CCCCC1.[O-]P(OC1CCCCC1)OC1CCCCC1.[Sb+3]
InChIInChI=1S/3C12H22O3P.Sb/c3*13-16(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12;/h3*11-12H,1-10H2;/q3*-1;+3
InChIKeyTXAPYFIWPVYSEU-UHFFFAOYSA-N
XLogP9.44
TPSA124.56 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds12
Heavy Atoms49
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500857.60
LogP ≤ 59.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

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Related Compounds

cyclohexyl phosphite;ethene
CID 22165796
dichloro(cyclododecyloxy)phosphane
CID 54169601
tricyclododecyl phosphite
CID 126731698
tricyclooctyl phosphite
CID 67250015
nickel;tetrakis(tricyclohexyl phosphite)
CID 173453545
benzene;tricyclohexyl phosphite
CID 70561522
1,4-bis[(4-cyclohexyloxycyclohexyl)oxy]cyclohexane
CID 140552812
cyclobutyloxycyclohexane
CID 89332762
cyclohexyl pentyl hydrogen phosphite
CID 174258819
silyloxycyclohexane
CID 19892694
CID 172763471
CID 172763471
methoxycyclooctane
CID 551195

Frequently Asked Questions

What is the IUPAC name of antimony(3+);tris(dicyclohexyl phosphite)?
The IUPAC name of antimony(3+);tris(dicyclohexyl phosphite) (CID 23464194) is antimony(3+);tris(dicyclohexyl phosphite).
What is the SMILES notation for antimony(3+);tris(dicyclohexyl phosphite)?
The canonical SMILES for antimony(3+);tris(dicyclohexyl phosphite) is [O-]P(OC1CCCCC1)OC1CCCCC1.[O-]P(OC1CCCCC1)OC1CCCCC1.[O-]P(OC1CCCCC1)OC1CCCCC1.[Sb+3].
What is the InChIKey of antimony(3+);tris(dicyclohexyl phosphite)?
The InChIKey is TXAPYFIWPVYSEU-UHFFFAOYSA-N. The full InChI is InChI=1S/3C12H22O3P.Sb/c3*13-16(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12;/h3*11-12H,1-10H2;/q3*-1;+3.
What are the key properties of antimony(3+);tris(dicyclohexyl phosphite)?
antimony(3+);tris(dicyclohexyl phosphite) has a molecular weight of 857.60 g/mol, XLogP of 9.44, 12 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for antimony(3+);tris(dicyclohexyl phosphite) is sourced from PubChem (CID 23464194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).