Bis(fluorosulfonyl)azanide;diethyl-methyl-propylazanium (CED0313799)

Record Information

Version

1.0

Creation Date

2026-09-01 13:26:24 UTC

Update Date

2026-09-01 13:26:24 UTC

SynCED ID

CED0313799

Secondary Accession Numbers

CHEM359668

Identification

Common Name

Bis(fluorosulfonyl)azanide;diethyl-methyl-propylazanium

Class

Small Molecule

Description

Bis(fluorosulfonyl)azanide;diethyl-methyl-propylazanium is a chemical compound with the formula C8H20F2N2O4S2. It has an average molecular weight of 310.40 g/mol.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₈H₂₀F₂N₂O₄S₂

Average Molecular Mass

Not Available

Monoisotopic Mass

310.083 g/mol

CAS Registry Number

1235234-32-8

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

CCC[N+](C)(CC)CC.[N-](S(=O)(=O)F)S(=O)(=O)F

InChI Identifier

InChI=1S/C8H20N.F2NO4S2/c1-5-8-9(4,6-2)7-3;1-8(4,5)3-9(2,6)7/h5-8H2,1-4H3;/q+1;-1

InChI Key

JVCJTUSCMOJHBG-UHFFFAOYSA-N

Chemical Taxonomy

Classification

Not classified

Biological Properties

Status

Detected and Not Quantified

Origin

Not Available

Cellular Locations

Not Available

Biofluid Locations

Not Available

Tissue Locations

Not Available

Applications

Not Available

Biological Roles

Not Available

Chemical Roles

Not Available

Organoleptic Effects

Not Available

Physical Properties

State

Not Available

Appearance

Not Available

Experimental Properties

Property	Value
Melting Point	Not Available
Boiling Point	Not Available
Solubility	Not Available

Predicted Properties

Not Available

Spectra

Not Available

Toxicity Profile

Toxicity Values

Toxicity Value	Organism	Dose Descriptor	Route of Exposure	Predicted or Experimental	Toxicity Rating	Reference
3951.0 Log mg/kg [2200:7000]	Rat	LD50	oral	predicted	Not Available	Not Available

Toxicity / Toxin Class

Not Available

Mechanism of Toxicity

Not Available

Carcinogenicity (IARC Classification)

Not Available

Minimum Risk Level

Not Available

Symptoms

Not Available

Treatment

Not Available

Health Effects

Health Effect	Relationship	Direction	Description	Reference

Exposure Sources

Source ID	Source	Sector	Reference
CEDs000519	Electrodes?Electrodes, used in various electrical and electronic applications, can be a source of synthetic chemical contamination due to the materials from which they are constructed and the processes involved in their manufacturing.	Electrical & Electronic Equipment	PubChem
CEDs000632	Apparel?Apparel production often involves the use of various synthetic chemicals, including dyes, finishing agents, and preservatives.	Textiles, leather & furnishings	PubChem

Pathways

0 pathwaysPathway Source: PathBank

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets

Structure	Protein	UniProt ID	Organism	Relationship	Details
Click to view 3D structure	Fatty-acid amide hydrolase 1	O00519	Humans	Predicted (SEA)	Prediction Confidence Score 0.201 Applicability Domain 0.281 Low confidence Statistical Significance 0.4088 Supporting Reference Compounds 106 E-value 3182.24
Click to view 3D structure	Sodium- and chloride-dependent creatine transporter 1	P28570	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.194 Applicability Domain 0.194 Low confidence Statistical Significance 0.0018 Supporting Reference Compounds 1 E-value 14.3243
Click to view 3D structure	Phospholipase B	Q9P8P2	Cryptococcus neoformans	Predicted (SEA)	Prediction Confidence Score 0.194 Applicability Domain 0.194 Low confidence Statistical Significance 0.0018 Supporting Reference Compounds 1 E-value 13.8572
Click to view 3D structure	Muscarinic acetylcholine receptor M1	P11229	Humans	Predicted (SEA)	Prediction Confidence Score 0.191 Applicability Domain 0.25 Low confidence Statistical Significance 0.7845 Supporting Reference Compounds 385 E-value 6107.27
Click to view 3D structure	Muscarinic acetylcholine receptor M3	P20309	Humans	Predicted (SEA)	Prediction Confidence Score 0.191 Applicability Domain 0.25 Low confidence Statistical Significance 0.719 Supporting Reference Compounds 310 E-value 5597.51
Click to view 3D structure	Fatty-acid amide hydrolase 1	O08914	Mus musculus	Predicted (SEA)	Prediction Confidence Score 0.19 Applicability Domain 0.281 Low confidence Statistical Significance 0.2532 Supporting Reference Compounds 46 E-value 1971.22
Click to view 3D structure	Muscarinic acetylcholine receptor M4	P08173	Humans	Predicted (SEA)	Prediction Confidence Score 0.185 Applicability Domain 0.25 Low confidence Statistical Significance 0.7738 Supporting Reference Compounds 297 E-value 6023.74
Click to view 3D structure	Liver carboxylesterase 1	P23141	Humans	Predicted (SEA)	Prediction Confidence Score 0.178 Applicability Domain 0.19 Low confidence Statistical Significance 0.225 Supporting Reference Compounds 55 E-value 1751.53
Click to view 3D structure	Cannabinoid receptor 1	P47746	Mus musculus	Predicted (SEA)	Prediction Confidence Score 0.178 Applicability Domain 0.281 Low confidence Statistical Significance 0.2277 Supporting Reference Compounds 42 E-value 1772.55
Click to view 3D structure	Liver carboxylesterase B-1	Q63010	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.176 Applicability Domain 0.19 Low confidence Statistical Significance 0.0048 Supporting Reference Compounds 6 E-value 37.2119
Click to view 3D structure	Cannabinoid receptor 1	P20272	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.175 Applicability Domain 0.281 Low confidence Statistical Significance 0.4498 Supporting Reference Compounds 83 E-value 3501.42
Click to view 3D structure	Fatty-acid amide hydrolase 1	P97612	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.175 Applicability Domain 0.281 Low confidence Statistical Significance 0.6202 Supporting Reference Compounds 102 E-value 4828.05
Click to view 3D structure	Carbonic anhydrase 12	O43570	Humans	Predicted (SEA)	Prediction Confidence Score 0.174 Applicability Domain 0.212 Low confidence Statistical Significance 0.7779 Supporting Reference Compounds 332 E-value 6055.74
Click to view 3D structure	Carbonic anhydrase 1	P00915	Humans	Predicted (SEA)	Prediction Confidence Score 0.174 Applicability Domain 0.212 Low confidence Statistical Significance 0.8065 Supporting Reference Compounds 407 E-value 6278.38
Click to view 3D structure	Liver carboxylesterase	Q29550	Sus scrofa	Predicted (SEA)	Prediction Confidence Score 0.173 Applicability Domain 0.19 Low confidence Statistical Significance 0.0869 Supporting Reference Compounds 20 E-value 676.432
Click to view 3D structure	Carbonic anhydrase 7	P43166	Humans	Predicted (SEA)	Prediction Confidence Score 0.166 Applicability Domain 0.212 Low confidence Statistical Significance 0.7994 Supporting Reference Compounds 242 E-value 6223.03
Click to view 3D structure	Solute carrier family 22 member 2	Q9R0W2	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.164 Applicability Domain 0.269 Low confidence Statistical Significance 0.0151 Supporting Reference Compounds 14 E-value 117.864
Click to view 3D structure	Juvenile hormone esterase	Q9GPG0	Manduca sexta	Predicted (SEA)	Prediction Confidence Score 0.162 Applicability Domain 0.167 Low confidence Statistical Significance 0.01 Supporting Reference Compounds 2 E-value 78.0828
Click to view 3D structure	Muscarinic acetylcholine receptor M5	P08912	Humans	Predicted (SEA)	Prediction Confidence Score 0.162 Applicability Domain 0.22 Low confidence Statistical Significance 0.9401 Supporting Reference Compounds 266 E-value 7318.29
Click to view 3D structure	Carbonic anhydrase 2	P00918	Humans	Predicted (SEA)	Prediction Confidence Score 0.162 Applicability Domain 0.189 Low confidence Statistical Significance 0.9276 Supporting Reference Compounds 472 E-value 7221.22
Click to view 3D structure	Muscarinic acetylcholine receptor M2	P08172	Humans	Predicted (SEA)	Prediction Confidence Score 0.161 Applicability Domain 0.22 Low confidence Statistical Significance 0.9721 Supporting Reference Compounds 373 E-value 7567.49
Click to view 3D structure	Carbonic anhydrase 9	Q16790	Humans	Predicted (SEA)	Prediction Confidence Score 0.159 Applicability Domain 0.189 Low confidence Statistical Significance 0.9139 Supporting Reference Compounds 372 E-value 7114.95
Click to view 3D structure	Cocaine esterase	O00748	Humans	Predicted (SEA)	Prediction Confidence Score 0.158 Applicability Domain 0.167 Low confidence Statistical Significance 0.4077 Supporting Reference Compounds 40 E-value 3173.6
Click to view 3D structure	Carbonic anhydrase 14	Q9ULX7	Humans	Predicted (SEA)	Prediction Confidence Score 0.158 Applicability Domain 0.212 Low confidence Statistical Significance 0.7978 Supporting Reference Compounds 172 E-value 6210.66
Click to view 3D structure	Acetylcholinesterase	P21836	Mus musculus	Predicted (SEA)	Prediction Confidence Score 0.158 Applicability Domain 0.172 Low confidence Statistical Significance 0.689 Supporting Reference Compounds 58 E-value 5363.81