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2-[4-(3,4-Xylyloxy)Butyl]Aminoethanethiol Sulfate
[CAS# 21220-70-2]

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CAS#: 21220-70-2
Product: 2-[4-(3,4-Xylyloxy)Butyl]Aminoethanethiol Sulfate
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Identification
Name 2-[4-(3,4-Xylyloxy)Butyl]Aminoethanethiol Sulfate
Synonyms 1,2-Dimethyl-4-[4-[2-(Sulfothio)Ethylamino]Butoxy]Benzene; 2-((4-(3,4-Xylyloxy)Butyl)Amino)Ethanethiol Hydrogen Sulfate (Ester); Brn 2149184
Molecular Structure CAS#: 21220-70-2, 2-[4-(3,4-Xylyloxy)Butyl]Aminoethanethiol Sulfate
Molecular Formula C14H23NO4S2
Molecular Weight 333.46
CAS Registry Number 21220-70-2
SMILES C1=C(C(=CC=C1OCCCCNCCS[S](=O)(=O)O)C)C
InChI 1S/C14H23NO4S2/c1-12-5-6-14(11-13(12)2)19-9-4-3-7-15-8-10-20-21(16,17)18/h5-6,11,15H,3-4,7-10H2,1-2H3,(H,16,17,18)
InChIKey GSRBCJMGWZTHLA-UHFFFAOYSA-N
Properties
Density 1.236g/cm3 (Cal.)
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