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2-(Diethylamino)ethanethiol

CAT: 0572-TRC-D443610-10GSize: 10 gDry Ice: NoHazardous: Yes
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CAT#:0572-TRC-D443610-10GSize:10 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
100-38-9
Synonyms
Ethanethiol, 2-(diethylamino)-; 2-(Diethylamino)ethanethiol; (2-Mercaptoethyl)diethylamine; 2-(Diethylamino)ethyl mercaptan; 2-(N,N-Diethylamino)ethanethiol; Diethyl(2-mercaptoethyl)amine; Diethylcysteamine; N,N-Diethylcysteamine; NSC 49193
Hazard Statement
Flammable liquid and vapour; UN number: UN1992; Packing Group: III
Smiles
CCN(CC)CCS
Molecular Formula
C6 H15 N S
Molecular Weight
133.26
InChI
InChI=1S/C6H15NS/c1-3-7(4-2)5-6-8/h8H,3-6H2,1-2H3
Additionnal Information
IUPAC name: 2-(diethylamino)ethanethiol
Shipping Conditions
Ice Packs
Storage Conditions
+4°C

Chemical Information

2-(Diethylamino)ethanethiol

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.

CAS Number100-38-9
PubChem CID16032
IUPAC Name2-(diethylamino)ethanethiol
Molecular FormulaC6H15NS
Molecular Weight133.26
XLogP1.3
Topological Polar Surface Area4.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count8
Formal Charge0
Complexity43
SMILES
CCN(CC)CCS
InChI
InChI=1S/C6H15NS/c1-3-7(4-2)5-6-8/h8H,3-6H2,1-2H3
InChIKey
YBDSNEVSFQMCTL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(Diethylamino)ethanethiol
CAS: 100-38-9
CID: 16032
Formula: C6H15NS
MW: 133.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight133.26
XLogP31.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass133.09252066
Monoisotopic Mass133.09252066
Topological Polar Surface Area4.2 Ų
Heavy Atom Count8
Formal Charge0
Complexity43.8
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
0094312- (Diethylamino) ethanethiol
MBS6112373-012-(Diethylamino)ethanethiol
OR1030465-012- (Butylamino) Ethanethiol
sc-2378882- (Trimethylsilyl) ethanethiol
E02680Ethanethiol
40292-35-1Ethanethiol, 2- (ethylsulfonyl) -
sc-2298492- (2-Methoxyethoxy) ethanethiol
OR1067277-012- (3-Aminopropylamino) ethanethiol
OR322254-012- (Boc-amino) ethanethiol
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