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13095-73-3,MFCD00053842
Catalog No.:AA000V2Z

13095-73-3 | Butanoic acid, 4-mercapto-

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
≥ 90% (GC)
in stock  
$152.00   $107.00
- +
5g
≥ 90% (GC)
in stock  
$505.00   $354.00
- +
25g
≥ 90% (GC)
in stock  
$1,874.00   $1,312.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA000V2Z
Chemical Name:
Butanoic acid, 4-mercapto-
CAS Number:
13095-73-3
Molecular Formula:
C4H8O2S
Molecular Weight:
120.1701
MDL Number:
MFCD00053842
SMILES:
SCCCC(=O)O
Properties
Properties
 
BP:
128-129°C @11mm  
Form:
Liquid  
Storage:
Keep in dry area;-20 ℃;  

Computed Properties
 
Complexity:
62.7  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
0.3  

Literature

Title: Does activation of the anti proton, rather than concertedness, determine the stereochemistry of base-catalyzed 1,2-elimination reactions? Anti stereospecificity in E1cB eliminations of β-3-trifluoromethylphenoxy esters, thioesters, and ketones.

Journal: The Journal of organic chemistry 20120316

Title: Olive oil-based fat emulsion versus soy oil-based fat emulsion in abdominal oncologic surgery.

Journal: Nutrition in clinical practice : official publication of the American Society for Parenteral and Enteral Nutrition 20110201

Title: Microbial 1-butanol production: Identification of non-native production routes and in silico engineering interventions.

Journal: Biotechnology journal 20100701

Title: Biodegradation of the xenobiotic organic disulphide 4,4'-dithiodibutyric acid by Rhodococcus erythropolis strain MI2 and comparison with the microbial utilization of 3,3'-dithiodipropionic acid and 3,3'-thiodipropionic acid.

Journal: Microbiology (Reading, England) 20100401

Title: Inhibitors of bacterial N-succinyl-L,L-diaminopimelic acid desuccinylase (DapE) and demonstration of in vitro antimicrobial activity.

Journal: Bioorganic & medicinal chemistry letters 20091115

Title: Effects of 4-methylimidazole on cerebral glutamate decarboxylase activity and specific GABA receptor binding in mice.

Journal: Toxicology mechanisms and methods 20090301

Title: Comparison of oxidative stress among migraineurs, tension-type headache subjects, and a control group.

Journal: Annals of Indian Academy of Neurology 20090101

Title: Protective role of vitamin E on the harmful effects of toluene on brain tissue.

Journal: Neurosciences (Riyadh, Saudi Arabia) 20070701

Title: Novel precursor substrates for polythioesters (PTE) and limits of PTE biosynthesis in Ralstonia eutropha.

Journal: FEMS microbiology letters 20030425

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SDS
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Tags:13095-73-3 Molecular Formula|13095-73-3 MDL|13095-73-3 SMILES|13095-73-3 Butanoic acid, 4-mercapto-
Catalog No.: AA000V2Z
13095-73-3,MFCD00053842
13095-73-3 | Butanoic acid, 4-mercapto-
Pack Size： 1g
Purity： ≥ 90% (GC)
in stock
$152.00 $107.00
Pack Size： 5g
Purity： ≥ 90% (GC)
in stock
$505.00 $354.00
Pack Size： 25g
Purity： ≥ 90% (GC)
in stock
$1,874.00 $1,312.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA000V2Z
Chemical Name: Butanoic acid, 4-mercapto-
CAS Number: 13095-73-3
Molecular Formula: C4H8O2S
Molecular Weight: 120.1701
MDL Number: MFCD00053842
SMILES: SCCCC(=O)O
Properties
BP: 128-129°C @11mm  
Form: Liquid  
Storage: Keep in dry area;-20 ℃;  
Complexity: 62.7  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 7  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 0.3  
Literature fold

Title: Does activation of the anti proton, rather than concertedness, determine the stereochemistry of base-catalyzed 1,2-elimination reactions? Anti stereospecificity in E1cB eliminations of β-3-trifluoromethylphenoxy esters, thioesters, and ketones.

Journal: The Journal of organic chemistry20120316

Title: Olive oil-based fat emulsion versus soy oil-based fat emulsion in abdominal oncologic surgery.

Journal: Nutrition in clinical practice : official publication of the American Society for Parenteral and Enteral Nutrition20110201

Title: Microbial 1-butanol production: Identification of non-native production routes and in silico engineering interventions.

Journal: Biotechnology journal20100701

Title: Biodegradation of the xenobiotic organic disulphide 4,4'-dithiodibutyric acid by Rhodococcus erythropolis strain MI2 and comparison with the microbial utilization of 3,3'-dithiodipropionic acid and 3,3'-thiodipropionic acid.

Journal: Microbiology (Reading, England)20100401

Title: Inhibitors of bacterial N-succinyl-L,L-diaminopimelic acid desuccinylase (DapE) and demonstration of in vitro antimicrobial activity.

Journal: Bioorganic & medicinal chemistry letters20091115

Title: Effects of 4-methylimidazole on cerebral glutamate decarboxylase activity and specific GABA receptor binding in mice.

Journal: Toxicology mechanisms and methods20090301

Title: Comparison of oxidative stress among migraineurs, tension-type headache subjects, and a control group.

Journal: Annals of Indian Academy of Neurology20090101

Title: Protective role of vitamin E on the harmful effects of toluene on brain tissue.

Journal: Neurosciences (Riyadh, Saudi Arabia)20070701

Title: Novel precursor substrates for polythioesters (PTE) and limits of PTE biosynthesis in Ralstonia eutropha.

Journal: FEMS microbiology letters20030425

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