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63165-02-6,MFCD00168835
Catalog No.:AA00J0XR

63165-02-6 | 4-(3-Hydroxy-3-methylbut-1-yn-1-yl)benzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$40.00   $28.00
- +
5g
95%
in stock  
$161.00   $113.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00J0XR
Chemical Name:
4-(3-Hydroxy-3-methylbut-1-yn-1-yl)benzoic acid
CAS Number:
63165-02-6
Molecular Formula:
C12H12O3
Molecular Weight:
204.2219
MDL Number:
MFCD00168835
SMILES:
OC(=O)c1ccc(cc1)C#CC(O)(C)C
Properties
Properties
 
BP:
370.7°C at 760 mmHg  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
297  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
15  
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:
2  

Literature
Quotation Request
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SDS
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Tags:63165-02-6 Molecular Formula|63165-02-6 MDL|63165-02-6 SMILES|63165-02-6 4-(3-Hydroxy-3-methylbut-1-yn-1-yl)benzoic acid
Catalog No.: AA00J0XR
63165-02-6,MFCD00168835
63165-02-6 | 4-(3-Hydroxy-3-methylbut-1-yn-1-yl)benzoic acid
Pack Size： 1g
Purity： 95%
in stock
$40.00 $28.00
Pack Size： 5g
Purity： 95%
in stock
$161.00 $113.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00J0XR
Chemical Name: 4-(3-Hydroxy-3-methylbut-1-yn-1-yl)benzoic acid
CAS Number: 63165-02-6
Molecular Formula: C12H12O3
Molecular Weight: 204.2219
MDL Number: MFCD00168835
SMILES: OC(=O)c1ccc(cc1)C#CC(O)(C)C
Properties
BP: 370.7°C at 760 mmHg  
Storage: Keep in dry area;2-8℃;  
Complexity: 297  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 15  
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: 2  
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