tris(2-hydroxyphenyl) arsorite

C18H15AsO6 — CID 139727037

IUPACtris(2-hydroxyphenyl) arsorite
SMILESOc1ccccc1O[As](Oc1ccccc1O)Oc1ccccc1O
InChIInChI=1S/C18H15AsO6/c20-13-7-1-4-10-16(13)23-19(24-17-11-5-2-8-14(17)21)25-18-12-6-3-9-15(18)22/h1-12,20-22H
InChIKeyIDSDSYGHADIVIH-UHFFFAOYSA-N
MW402.23 g/mol
LogP3.33
Rot. Bonds6

About tris(2-hydroxyphenyl) arsorite

tris(2-hydroxyphenyl) arsorite (PubChem CID 139727037) has the molecular formula C18H15AsO6 and a molecular weight of 402.23 g/mol. Its IUPAC name is tris(2-hydroxyphenyl) arsorite.

Molecular Properties

Compound Nametris(2-hydroxyphenyl) arsorite
PubChem CID139727037
Molecular FormulaC18H15AsO6
Molecular Weight402.23 g/mol
Exact Mass402.01
IUPAC Nametris(2-hydroxyphenyl) arsorite
SMILESOc1ccccc1O[As](Oc1ccccc1O)Oc1ccccc1O
InChIInChI=1S/C18H15AsO6/c20-13-7-1-4-10-16(13)23-19(24-17-11-5-2-8-14(17)21)25-18-12-6-3-9-15(18)22/h1-12,20-22H
InChIKeyIDSDSYGHADIVIH-UHFFFAOYSA-N
XLogP3.33
TPSA88.38 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.23
LogP ≤ 53.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze tris(2-hydroxyphenyl) arsorite with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethene;2-(2-hydroxyphenyl)peroxyphenol
CID 163415506
2-(2-hydroxyphenoxy)phenol;phosphane
CID 174791785
benzene-1,2-diol;ruthenium
CID 175866633
azane;2-methoxyphenol
CID 172717837
2-[6-(2-hydroxyphenoxy)naphthalen-2-yl]oxyphenol
CID 175775609
2-methylperoxyphenol
CID 18702042
methanethiol;2-methoxyphenol
CID 141484211
2-methoxyphenol;molecular bromine
CID 141484212
bis(2-hydroxyphenoxy)borinic acid
CID 19048509
2-(4-methoxyphenoxy)phenol
CID 54145402
2-[2,3-bis(2-hydroxyphenoxy)phenoxy]phenol
CID 139940614
formonitrile;2-methoxyphenol
CID 161059546

Frequently Asked Questions

What is the IUPAC name of tris(2-hydroxyphenyl) arsorite?
The IUPAC name of tris(2-hydroxyphenyl) arsorite (CID 139727037) is tris(2-hydroxyphenyl) arsorite.
What is the SMILES notation for tris(2-hydroxyphenyl) arsorite?
The canonical SMILES for tris(2-hydroxyphenyl) arsorite is Oc1ccccc1O[As](Oc1ccccc1O)Oc1ccccc1O.
What is the InChIKey of tris(2-hydroxyphenyl) arsorite?
The InChIKey is IDSDSYGHADIVIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15AsO6/c20-13-7-1-4-10-16(13)23-19(24-17-11-5-2-8-14(17)21)25-18-12-6-3-9-15(18)22/h1-12,20-22H.
What are the key properties of tris(2-hydroxyphenyl) arsorite?
tris(2-hydroxyphenyl) arsorite has a molecular weight of 402.23 g/mol, XLogP of 3.33, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for tris(2-hydroxyphenyl) arsorite is sourced from PubChem (CID 139727037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).