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31284-89-6,MFCD00961860
Catalog No.:AA003HAT
31284-89-6 | 2-Hydroxy-2-(4-methylphenyl)acetic acid
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$60.00
- +
5g
98%
in stock  
$195.00
- +
25g
98%
in stock  
$556.00
- +
  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003HAT
Chemical Name:
2-Hydroxy-2-(4-methylphenyl)acetic acid
CAS Number:
31284-89-6
Molecular Formula:
C9H10O3
Molecular Weight:
166.1739
MDL Number:
MFCD00961860
IUPAC Name:
(2R)-2-hydroxy-2-(4-methylphenyl)acetic acid
InChI:
InChI=1S/C9H10O3/c1-6-2-4-7(5-3-6)8(10)9(11)12/h2-5,8,10H,1H3,(H,11,12)/t8-/m1/s1
InChI Key:
SFGURAWGCAPHON-MRVPVSSYSA-N
SMILES:
O[C@H](c1ccc(cc1)C)C(=O)O
Properties
Computed Properties
 
Complexity:
159  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
166.063g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
166.176g/mol
Monoisotopic Mass:
166.063g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  

Synonyms
 
4-Methyl-D-mandelic acid 
(R)-4-Methylmandelic acid 
AKOS025310775 
FCH1121451 
ACM31284896 
AS-17448 
(R)-(-)-4-Methylmandelic acid, ChiPros 
V0170 
(2R)-2-hydroxy-2-(4-methylphenyl)acetic acid 
284M896 
(R)-4-Methylmandelic acid, ChiPros(R), produced by BASF, 98% 
4-Methylmandelic acid 
31284-89-6 
C9H10O3 
2-hydroxy-2-(4-methylphenyl)acetic acid 
(R)-(-)-4-Methylmandelic acid 
MFCD00798433 
(R)-alpha-Hydroxy(4-methylphenyl)acetic acid 
(R)-Para-methylmandelic acid 
SCHEMBL366066 
ZINC1715277 
(R)-2-hydroxy-2-p-tolylacetic acid 
Literature
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