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Basic information
- CAS
100-38-9- Standard SMILES
CCN(CC)CCS- InChIKey
YBDSNEVSFQMCTL-UHFFFAOYSA-N- Molecular formula
- C6H15NS
- Average molar mass
- 133.26 g/mol
- Monoisotopic mass
- 133.09252048
Overview
This is a chemical weapon precursor or chemical weapon impurity which is similar to 2-diethylaminoethanol. See the chemical datasheet for 2-diethylaminoethanol for more information.
Names & identifiers
- Preferred name
- 2-(Diethylamino)ethanethiol
- IUPAC
- 2-(diethylamino)ethanethiol
Names & synonyms
2-(Diethylamino)ethanethiol100-38-9DiethylcysteamineEthanethiol, 2-(diethylamino)-Diethyl(2-mercaptoethyl)amine2-(Diethylamino)ethyl mercaptanTF6S7Q84YDNSC-49193DTXSID1074414RefChem:587351DTXCID9032452202-846-8
Show more names
2-DiethylaminoethanethiolDiethylcysteaminDiethylaminoethanethiolN-Diaethyl cysteamin2-(diethylamino)ethane-1-thiolTriethylamine, 2-mercapto-N,N-DiethylcysteamineTiamulin EP Impurity O
Database identifiers
- CAS
100-38-9- PubChem CID
- 16032
- DTXSID
DTXSID1074414- UNII
- TF6S7Q84YD
- EC Number
- 202-846-8
- Nikkaji
- J15.780E
Properties
Computed structural propertiesFilling in
- XLogP
- 1.3
- Topological polar surface area
- 4.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 43.8
Experimental & physicochemical properties
Physical DescriptionThis is a chemical weapon precursor or chemical weapon impurity which is similar to 2-diethylaminoethanol. See the chemical datasheet for 2-diethylaminoethanol for more information.
Safety & regulation
GHS classification
GHS Classification
Danger
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P261, P264, P270, P272, P280, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P330, P333+P317, P362+P364, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 4 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information2-(Diethylamino)ethanethiol: Does not have an individual approval but may be used under an appropriate group standard
Reactive GroupAmines, Phosphines, and Pyridines
Air and Water ReactionsNo rapid reaction with air. No rapid reaction with water.
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
DHS Chemicals of Interest (COI)
N,N-(2-diethylamino)ethanethiol
30.00
2.2
Chemical Weapons/Chemical Weapons Precursors chemical material that, if stolen or diverted, can be converted into weapons using simple chemistry, equipment, or techniques.
Regulatory information
DHS Chemicals of Interest (COI)
N,N-(2-diethylamino)ethanethiol
30.00
2.2
Chemical Weapons/Chemical Weapons Precursors chemical material that, if stolen or diverted, can be converted into weapons using simple chemistry, equipment, or techniques.
Related reactions
32 records
Compound notes
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