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Home Other Building Blocks 66147-29-3
66147-29-3,MFCD30720350
Catalog No.:AA00FDAY

66147-29-3 | Methotrexate α-Methyl Ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
> 95%
2 weeks  
$3,640.00   $2,548.00
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Technical Information
Catalog Number:
AA00FDAY
Chemical Name:
Methotrexate α-Methyl Ester
CAS Number:
66147-29-3
Molecular Formula:
C21H24N8O5
Molecular Weight:
468.4659
MDL Number:
MFCD30720350
SMILES:
COC(=O)[C@@H](NC(=O)c1ccc(cc1)N(Cc1cnc2c(n1)c(N)nc(n2)N)C)CCC(=O)O
Properties
Computed Properties
 
Complexity:
719  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Heavy Atom Count:
34  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
4  
Rotatable Bond Count:
10  
XLogP3:
-1.5  

Literature
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Additional Info:
SDS
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Tags:66147-29-3 Molecular Formula|66147-29-3 MDL|66147-29-3 SMILES|66147-29-3 Methotrexate α-Methyl Ester