triethyl arsorate

C6H15AsO4 — CID 586279

IUPACtriethyl arsorate
SMILESCCO[As](=O)(OCC)OCC
InChIInChI=1S/C6H15AsO4/c1-4-9-7(8,10-5-2)11-6-3/h4-6H2,1-3H3
InChIKeyMGRFDZWQSJNJQP-UHFFFAOYSA-N
MW226.10 g/mol
LogP0.96
Rot. Bonds6

About triethyl arsorate

triethyl arsorate (PubChem CID 586279) has the molecular formula C6H15AsO4 and a molecular weight of 226.10 g/mol. Its IUPAC name is triethyl arsorate.

Molecular Properties

Compound Nametriethyl arsorate
PubChem CID586279
Molecular FormulaC6H15AsO4
Molecular Weight226.10 g/mol
Exact Mass226.02
IUPAC Nametriethyl arsorate
SMILESCCO[As](=O)(OCC)OCC
InChIInChI=1S/C6H15AsO4/c1-4-9-7(8,10-5-2)11-6-3/h4-6H2,1-3H3
InChIKeyMGRFDZWQSJNJQP-UHFFFAOYSA-N
XLogP0.96
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.10
LogP ≤ 50.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

cyanato(ethoxy)arsinic acid
CID 151771906
ethylmercury;silicic acid
CID 174832144
ethoxy(2-ethoxysilylethenyl)silane
CID 123656426
ethoxy(methoxy)silane
CID 123212051
CID 151110604
CID 151110604
1,2-diethoxyethane;hydrofluoride
CID 175535770
ethoxyethane;oxophosphane
CID 18547249
ethoxyethane;formaldehyde
CID 174286087
1-ethoxy-2-[2-[2-[2-(2-ethoxyethylsulfanyl)ethylsulfanyl]ethylsulfanyl]ethylsulfanyl]ethane
CID 5171446
ethoxy(hydroxysilyl)silane
CID 123524431
CID 101447150
CID 101447150
N,N-bis(2-ethoxyethyl)ethanesulfonamide
CID 82952267

Frequently Asked Questions

What is the IUPAC name of triethyl arsorate?
The IUPAC name of triethyl arsorate (CID 586279) is triethyl arsorate.
What is the SMILES notation for triethyl arsorate?
The canonical SMILES for triethyl arsorate is CCO[As](=O)(OCC)OCC.
What is the InChIKey of triethyl arsorate?
The InChIKey is MGRFDZWQSJNJQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15AsO4/c1-4-9-7(8,10-5-2)11-6-3/h4-6H2,1-3H3.
What are the key properties of triethyl arsorate?
triethyl arsorate has a molecular weight of 226.10 g/mol, XLogP of 0.96, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl arsorate is sourced from PubChem (CID 586279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).