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4160-92-3,MFCD00020491
Catalog No.:AA00D603

4160-92-3 | 3-Methyl-3-phenylpentanedioic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
50mg
90%
3 weeks  
$452.00   $317.00
- +
100mg
90%
3 weeks  
$534.00   $374.00
- +
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  • Technical Information
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Technical Information
Catalog Number:
AA00D603
Chemical Name:
3-Methyl-3-phenylpentanedioic acid
CAS Number:
4160-92-3
Molecular Formula:
C12H14O4
Molecular Weight:
222.2372
MDL Number:
MFCD00020491
SMILES:
OC(=O)CC(c1ccccc1)(CC(=O)O)C
NSC Number:
51135
Properties
Computed Properties
 
Complexity:
250  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
5  
XLogP3:
1.5  

Literature

Title: SAR and X-ray. A new approach combining fragment-based screening and rational drug design: application to the discovery of nanomolar inhibitors of Src SH2.

Journal: Journal of medicinal chemistry 20020606

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SDS
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Tags:4160-92-3 Molecular Formula|4160-92-3 MDL|4160-92-3 SMILES|4160-92-3 3-Methyl-3-phenylpentanedioic acid