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42580-38-1,MFCD12784660
Catalog No.:AA00D76M

42580-38-1 | 2-((4-Hydroxyphenyl)thio)acetic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
50mg
95%
3 weeks  
$368.00   $258.00
- +
100mg
95%
3 weeks  
$517.00   $362.00
- +
250mg
95%
3 weeks  
$713.00   $499.00
- +
500mg
95%
3 weeks  
$1,092.00   $764.00
- +
1g
95%
3 weeks  
$1,384.00   $969.00
- +
2.5g
95%
3 weeks  
$2,654.00   $1,858.00
- +
5g
95%
3 weeks  
$3,900.00   $2,730.00
- +
10g
95%
3 weeks  
$5,756.00   $4,029.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00D76M
Chemical Name:
2-((4-Hydroxyphenyl)thio)acetic acid
CAS Number:
42580-38-1
Molecular Formula:
C8H8O3S
Molecular Weight:
184.2123
MDL Number:
MFCD12784660
SMILES:
OC(=O)CSc1ccc(cc1)O
NSC Number:
125981
Properties
Computed Properties
 
Complexity:
152  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.5  

Downstream Synthesis Route

[1]EuropeanJournalofMedicinalChemistry,1999,vol.34,p.1023-1034

Literature

Title: Synthesis and preliminary in vitro biological evaluation of 4-[(4-hydroxyphenyl)sulfanyl]but-3-en-2-one, a 4-mercaptophenol derivative designed as a novel bifunctional antimelanoma agent.

Journal: Journal of medicinal chemistry 20090813

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SDS
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Tags:42580-38-1 Molecular Formula|42580-38-1 MDL|42580-38-1 SMILES|42580-38-1 2-((4-Hydroxyphenyl)thio)acetic acid
Catalog No.: AA00D76M
42580-38-1,MFCD12784660
42580-38-1 | 2-((4-Hydroxyphenyl)thio)acetic acid
Pack Size： 50mg
Purity： 95%
3 weeks
$368.00 $258.00
Pack Size： 100mg
Purity： 95%
3 weeks
$517.00 $362.00
Pack Size： 250mg
Purity： 95%
3 weeks
$713.00 $499.00
Pack Size： 500mg
Purity： 95%
3 weeks
$1,092.00 $764.00
Pack Size： 1g
Purity： 95%
3 weeks
$1,384.00 $969.00
Pack Size： 2.5g
Purity： 95%
3 weeks
$2,654.00 $1,858.00
Pack Size： 5g
Purity： 95%
3 weeks
$3,900.00 $2,730.00
Pack Size： 10g
Purity： 95%
3 weeks
$5,756.00 $4,029.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00D76M
Chemical Name: 2-((4-Hydroxyphenyl)thio)acetic acid
CAS Number: 42580-38-1
Molecular Formula: C8H8O3S
Molecular Weight: 184.2123
MDL Number: MFCD12784660
SMILES: OC(=O)CSc1ccc(cc1)O
NSC Number: 125981
Properties
Complexity: 152  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.5  
Downstream Synthesis Route
28743-98-8    42580-38-1 

[1]EuropeanJournalofMedicinalChemistry,1999,vol.34,p.1023-1034

Literature fold

Title: Synthesis and preliminary in vitro biological evaluation of 4-[(4-hydroxyphenyl)sulfanyl]but-3-en-2-one, a 4-mercaptophenol derivative designed as a novel bifunctional antimelanoma agent.

Journal: Journal of medicinal chemistry20090813

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Historical Records
877653-84-4
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