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59469-29-3,MFCD06795912
Catalog No.:AA00E8R6

59469-29-3 | 2-AMINOMETHYL-7-CHLORO-2,3-DIHYDRO-5-(2-FLUOROPHENYL)-1H-1,4-BENZODIAZEPINE DIMALEATE

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Technical Information
Catalog Number:
AA00E8R6
Chemical Name:
2-AMINOMETHYL-7-CHLORO-2,3-DIHYDRO-5-(2-FLUOROPHENYL)-1H-1,4-BENZODIAZEPINE DIMALEATE
CAS Number:
59469-29-3
Molecular Formula:
C24H23ClFN3O8
Molecular Weight:
535.9061
MDL Number:
MFCD06795912
SMILES:
OC(=O)/C=C\C(=O)O.OC(=O)/C=C\C(=O)O.NCC1CN=C(c2c(N1)ccc(c2)Cl)c1ccccc1F
Properties
Properties
 
MP:
179-181˚C  
Storage:
2-8℃;  

Computed Properties
 
Complexity:
509  
Covalently-Bonded Unit Count:
3  
Defined Bond Stereocenter Count:
2  
Heavy Atom Count:
37  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
6  
Rotatable Bond Count:
6  
Undefined Atom Stereocenter Count:
1  

Literature
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SDS
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Tags:59469-29-3 Molecular Formula|59469-29-3 MDL|59469-29-3 SMILES|59469-29-3 2-AMINOMETHYL-7-CHLORO-2,3-DIHYDRO-5-(2-FLUOROPHENYL)-1H-1,4-BENZODIAZEPINE DIMALEATE