CID 153455866

HIO14S — CID 153455866

IUPAC—
SMILESO=S(=O)(I)OOOOOOOOOOOO
InChIInChI=1S/HIO14S/c1-16(3,4)15-14-13-12-11-10-9-8-7-6-5-2/h2H
InChIKeyJGXGLLNWZFYIAY-UHFFFAOYSA-N
MW383.97 g/mol
LogP-0.53
Rot. Bonds11

About CID 153455866

CID 153455866 (PubChem CID 153455866) has the molecular formula HIO14S and a molecular weight of 383.97 g/mol.

Molecular Properties

Compound NameCID 153455866
PubChem CID153455866
Molecular FormulaHIO14S
Molecular Weight383.97 g/mol
Exact Mass383.81
IUPAC Name—
SMILESO=S(=O)(I)OOOOOOOOOOOO
InChIInChI=1S/HIO14S/c1-16(3,4)15-14-13-12-11-10-9-8-7-6-5-2/h2H
InChIKeyJGXGLLNWZFYIAY-UHFFFAOYSA-N
XLogP-0.53
TPSA155.90 Ų
H-Bond Donors1
H-Bond Acceptors14
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500383.97
LogP ≤ 5-0.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1014

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

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Related Compounds

CID 59279399
CID 59279399
CID 160619880
CID 160619880
hydroperoxyperoxyperoxyperoxyperoxyperoxyperoxyperoxyperoxyperoxyperoxyperoxyperoxyperoxyperoxyperoxyperoxyperoxyperoxyperoxyperoxymethane
CID 121449840
trioxidanylperoxy formate
CID 59425519
hydroperoxyperoxyperoxyperoxyperoxy hypobromite
CID 58903514
methylperoxyperoxyperoxyperoxyperoxyperoxyperoxyperoxyperoxyperoxyperoxyperoxy methanesulfonate
CID 156622764
cobalt;hydroperoxyperoxyperoxymethanone
CID 153296876
CID 174147118
CID 174147118
sulfuroiodidic acid
CID 20836541
dihydroxy(trioxidanylperoxyperoxyperoxyperoxyperoxyperoxyperoxy)oxidanium
CID 16750108
hydroperoxyperoxyperoxymethanol
CID 89139008
sulfuryl diiodide
CID 22177328

Frequently Asked Questions

What is the IUPAC name of CID 153455866?
The IUPAC name of CID 153455866 (CID 153455866) is not available.
What is the SMILES notation for CID 153455866?
The canonical SMILES for CID 153455866 is O=S(=O)(I)OOOOOOOOOOOO.
What is the InChIKey of CID 153455866?
The InChIKey is JGXGLLNWZFYIAY-UHFFFAOYSA-N. The full InChI is InChI=1S/HIO14S/c1-16(3,4)15-14-13-12-11-10-9-8-7-6-5-2/h2H.
What are the key properties of CID 153455866?
CID 153455866 has a molecular weight of 383.97 g/mol, XLogP of -0.53, 11 rotatable bonds, 1 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for CID 153455866 is sourced from PubChem (CID 153455866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).