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Home Aminos 2-(Butylamino)ethanethiol

2-(Butylamino)ethanethiol

CAS No.:
5842-00-2
Catalog Number:
AG003F03
Molecular Formula:
C6H15NS
Molecular Weight:
133.2550
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
1 week
United States
$167
- +
5g
1 week
United States
$400
- +
10g
1 week
United States
$653
- +
25g
1 week
United States
$1380
- +
Product Description
Catalog Number:
AG003F03
Chemical Name:
2-(Butylamino)ethanethiol
CAS Number:
5842-00-2
Molecular Formula:
C6H15NS
Molecular Weight:
133.2550
MDL Number:
MFCD00004888
IUPAC Name:
2-(butylamino)ethanethiol
InChI:
InChI=1S/C6H15NS/c1-2-3-4-7-5-6-8/h7-8H,2-6H2,1H3
InChI Key:
OUMFAUYLXGTBCX-UHFFFAOYSA-N
SMILES:
CCCCNCCS
EC Number:
227-431-9
NSC Number:
82296
Properties
Complexity:
39.5  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
133.093g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
133.253g/mol
Monoisotopic Mass:
133.093g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
13A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Literature
Title Journal
Ionization mechanism of the ambient pressure pyroelectric ion source (APPIS) and its applications to chemical nerve agent detection. Journal of the American Society for Mass Spectrometry 20091101
Photocatalytic oxidation of VX simulant 2-(butylamino)ethanethiol. Journal of hazardous materials 20040910
Properties