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4865-84-3,MFCD02180388
Catalog No.:AA006W99

4865-84-3 | 2-(1,2-Benzisoxazol-3-yl)acetic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
98%
in stock  
$17.00   $12.00
- +
25g
98%
in stock  
$46.00   $32.00
- +
100g
98%
in stock  
$173.00   $121.00
- +
500g
98%
in stock  
$781.00 $547.00
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA006W99
Chemical Name:
2-(1,2-Benzisoxazol-3-yl)acetic acid
CAS Number:
4865-84-3
Molecular Formula:
C9H7NO3
Molecular Weight:
177.1568
MDL Number:
MFCD02180388
SMILES:
OC(=O)Cc1noc2c1cccc2
NSC Number:
179803
Properties
Properties
 
BP:
377.3°C at 760 mmHg  
Form:
Solid  
MP:
123 °C  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
207  
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:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.2  

Synonyms
 
  
Literature

Title: Structurally Diverse Mitochondrial Branched Chain Aminotransferase (BCATm) Leads with Varying Binding Modes Identified by Fragment Screening.

Journal: Journal of medicinal chemistry 20160324

Title: HPLC method for simultaneous determination of impurities and degradation products in zonisamide.

Journal: Indian journal of pharmaceutical sciences 20090101

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SDS
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Tags:4865-84-3 Molecular Formula|4865-84-3 MDL|4865-84-3 SMILES|4865-84-3 2-(1,2-Benzisoxazol-3-yl)acetic acid
Catalog No.: AA006W99
4865-84-3,MFCD02180388
4865-84-3 | 2-(1,2-Benzisoxazol-3-yl)acetic acid
Pack Size： 5g
Purity： 98%
in stock
$17.00 $12.00
Pack Size： 25g
Purity： 98%
in stock
$46.00 $32.00
Pack Size： 100g
Purity： 98%
in stock
$173.00 $121.00
Pack Size： 500g
Purity： 98%
in stock
$781.00 $547.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA006W99
Chemical Name: 2-(1,2-Benzisoxazol-3-yl)acetic acid
CAS Number: 4865-84-3
Molecular Formula: C9H7NO3
Molecular Weight: 177.1568
MDL Number: MFCD02180388
SMILES: OC(=O)Cc1noc2c1cccc2
NSC Number: 179803
Properties
BP: 377.3°C at 760 mmHg  
Form: Solid  
MP: 123 °C  
Storage: Keep in dry area;2-8℃;  
Complexity: 207  
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: 4  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.2  
75:   
Literature fold

Title: Structurally Diverse Mitochondrial Branched Chain Aminotransferase (BCATm) Leads with Varying Binding Modes Identified by Fragment Screening.

Journal: Journal of medicinal chemistry20160324

Title: HPLC method for simultaneous determination of impurities and degradation products in zonisamide.

Journal: Indian journal of pharmaceutical sciences20090101

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