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915297-48-2,MFCD29036919
Catalog No.:AA00GX0D

915297-48-2 | rac2-Oleoyl-3-chloropropanediol

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Technical Information
Catalog Number:
AA00GX0D
Chemical Name:
rac2-Oleoyl-3-chloropropanediol
CAS Number:
915297-48-2
Molecular Formula:
C25H39N3O5
Molecular Weight:
461.5943
MDL Number:
MFCD29036919
SMILES:
COCCCOc1cc(ccc1OC)C[C@H](C(C)C)C[C@@H]([C@H]1OC(=O)[C@@H](C1)C(C)C)N=[N+]=[N-]
Properties
Computed Properties
 
Complexity:
318  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
19  
Undefined Atom Stereocenter Count:
1  
XLogP3:
7.6  

Literature
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SDS
Tags:915297-48-2 Molecular Formula|915297-48-2 MDL|915297-48-2 SMILES|915297-48-2 rac2-Oleoyl-3-chloropropanediol