bromocopper;triethyl phosphite

C6H15BrCuO3P — CID 12653173

IUPACbromocopper;triethyl phosphite
SMILESCCOP(OCC)OCC.[Cu]Br
InChIInChI=1S/C6H15O3P.BrH.Cu/c1-4-7-10(8-5-2)9-6-3;;/h4-6H2,1-3H3;1H;/q;;+1/p-1
InChIKeySVDNZAFMXBRSHK-UHFFFAOYSA-M
MW309.61 g/mol
LogP3.17
Rot. Bonds6

About bromocopper;triethyl phosphite

bromocopper;triethyl phosphite (PubChem CID 12653173) has the molecular formula C6H15BrCuO3P and a molecular weight of 309.61 g/mol. Its IUPAC name is bromocopper;triethyl phosphite.

Molecular Properties

Compound Namebromocopper;triethyl phosphite
PubChem CID12653173
Molecular FormulaC6H15BrCuO3P
Molecular Weight309.61 g/mol
Exact Mass307.92
IUPAC Namebromocopper;triethyl phosphite
SMILESCCOP(OCC)OCC.[Cu]Br
InChIInChI=1S/C6H15O3P.BrH.Cu/c1-4-7-10(8-5-2)9-6-3;;/h4-6H2,1-3H3;1H;/q;;+1/p-1
InChIKeySVDNZAFMXBRSHK-UHFFFAOYSA-M
XLogP3.17
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.61
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bromocopper;triethyl phosphite?
The IUPAC name of bromocopper;triethyl phosphite (CID 12653173) is bromocopper;triethyl phosphite.
What is the SMILES notation for bromocopper;triethyl phosphite?
The canonical SMILES for bromocopper;triethyl phosphite is CCOP(OCC)OCC.[Cu]Br.
What is the InChIKey of bromocopper;triethyl phosphite?
The InChIKey is SVDNZAFMXBRSHK-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H15O3P.BrH.Cu/c1-4-7-10(8-5-2)9-6-3;;/h4-6H2,1-3H3;1H;/q;;+1/p-1.
What are the key properties of bromocopper;triethyl phosphite?
bromocopper;triethyl phosphite has a molecular weight of 309.61 g/mol, XLogP of 3.17, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for bromocopper;triethyl phosphite is sourced from PubChem (CID 12653173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).