Home Amines 104253-47-6
104253-47-6,MFCD24642265
Catalog No.:AA0093JI

104253-47-6 | 5-Amino-2-chloro-4-methoxy-benzoic acid methyl ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$112.00   $78.00
- +
1g
98%
in stock  
$245.00   $171.00
- +
5g
98%
in stock  
$743.00   $520.00
- +
10g
98%
in stock  
$1,258.00   $881.00
- +
25g
98%
in stock  
$2,505.00   $1,754.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0093JI
Chemical Name:
5-Amino-2-chloro-4-methoxy-benzoic acid methyl ester
CAS Number:
104253-47-6
Molecular Formula:
C9H10ClNO3
Molecular Weight:
215.6336
MDL Number:
MFCD24642265
SMILES:
COC(=O)c1cc(N)c(cc1Cl)OC
Properties
Computed Properties
 
Complexity:
212  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
1.7  

Downstream Synthesis Route

[1]CurrentPatentAssignee:ASTRAZENECAPLC-WO2009/47558,2009,A1Locationinpatent:Page/Pagecolumn164

[1]CurrentPatentAssignee:ASTRAZENECAPLC-WO2009/47558,2009,A1Locationinpatent:Page/Pagecolumn164

[2]McCoull,William;Barton,Peter;Brown,AlastairJ.H.;Bowker,SuzanneS.;Cameron,Jennifer;Clarke,DavidS.;Davies,RobertD.M.;Dossetter,AlexanderG.;Ertan,Anne;Fenwick,Mark;Green,Clive;Holmes,JaneL.;Martin,Nathaniel;Masters,David;Moore,JaneE.;Newcombe,NicholasJ.;Newton,Claire;Pointon,Helen;Robb,GraemeR.;Sheldon,Christopher;Stokes,Stephen;Morgan,David[JournalofMedicinalChemistry,2014,vol.57,#14,p.6128-6140]

Literature
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SDS
Tags:104253-47-6 Molecular Formula|104253-47-6 MDL|104253-47-6 SMILES|104253-47-6 5-Amino-2-chloro-4-methoxy-benzoic acid methyl ester