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41394-95-0,MFCD07364761
Catalog No.:AA00CLPP

41394-95-0 | 2-(Isopropylsulfanyl)benzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$91.00   $64.00
- +
5g
98%
in stock  
$250.00   $175.00
- +
25g
98%
in stock  
$583.00   $408.00
- +
100g
98%
in stock  
$1,567.00 $1,097.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00CLPP
Chemical Name:
2-(Isopropylsulfanyl)benzoic acid
CAS Number:
41394-95-0
Molecular Formula:
C10H12O2S
Molecular Weight:
196.2661
MDL Number:
MFCD07364761
SMILES:
CC(Sc1ccccc1C(=O)O)C
Properties
Properties
 
Storage:
Room Temperature;  

Computed Properties
 
Complexity:
180  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.8  

Downstream Synthesis Route

[1]JournaloftheAmericanChemicalSociety,1949,vol.71,p.4062,4063

[1]JournaloftheAmericanChemicalSociety,1949,vol.71,p.4062,4063

[1]PhosphorusandSulfurandtheRelatedElements,1981,vol.12,p.353-356

[1]JournaloftheChemicalSociety.PerkintransactionsI,1994,p.155-160

[1]JournaloftheChemicalSociety.PerkintransactionsI,1994,p.155-160

Literature
Quotation Request
Company Name:
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Contact Person:
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Quantity Required:
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Additional Info:
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SDS
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537043-43-9
Tags:41394-95-0 Molecular Formula|41394-95-0 MDL|41394-95-0 SMILES|41394-95-0 2-(Isopropylsulfanyl)benzoic acid
Catalog No.: AA00CLPP
41394-95-0,MFCD07364761
41394-95-0 | 2-(Isopropylsulfanyl)benzoic acid
Pack Size： 1g
Purity： 98%
in stock
$91.00 $64.00
Pack Size： 5g
Purity： 98%
in stock
$250.00 $175.00
Pack Size： 25g
Purity： 98%
in stock
$583.00 $408.00
Pack Size： 100g
Purity： 98%
in stock
$1,567.00 $1,097.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00CLPP
Chemical Name: 2-(Isopropylsulfanyl)benzoic acid
CAS Number: 41394-95-0
Molecular Formula: C10H12O2S
Molecular Weight: 196.2661
MDL Number: MFCD07364761
SMILES: CC(Sc1ccccc1C(=O)O)C
Properties
Storage: Room Temperature;  
Complexity: 180  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.8  
Downstream Synthesis Route
109-72-8    60-29-7    3019-20-3    41394-95-0 

[1]JournaloftheAmericanChemicalSociety,1949,vol.71,p.4062,4063

75-26-3    4892-02-8    41394-95-0 

[1]JournaloftheAmericanChemicalSociety,1949,vol.71,p.4062,4063

124-38-9    3019-20-3    41394-95-0 

[1]PhosphorusandSulfurandtheRelatedElements,1981,vol.12,p.353-356

154550-04-6    41394-95-0 

[1]JournaloftheChemicalSociety.PerkintransactionsI,1994,p.155-160

41394-95-0    74-88-4    154550-03-5 

[1]JournaloftheChemicalSociety.PerkintransactionsI,1994,p.155-160

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Historical Records
537043-43-9
537043-43-9
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