379255-82-0,MFCD03147409
Catalog No.:AA019GO6

379255-82-0 | 4-(3-Nitro-benzylidene)-1,2,3,4-tetrahydro-acridine-9-carboxylic acid

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Technical Information
Catalog Number:
AA019GO6
Chemical Name:
4-(3-Nitro-benzylidene)-1,2,3,4-tetrahydro-acridine-9-carboxylic acid
CAS Number:
379255-82-0
Molecular Formula:
C21H16N2O4
Molecular Weight:
360.3627
MDL Number:
MFCD03147409
SMILES:
OC(=O)c1c2CCCC(=Cc3cccc(c3)[N+](=O)[O-])c2nc2c1cccc2
Properties
Computed Properties
 
Complexity:
614  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
1  
XLogP3:
4.3  

Literature
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SDS
Tags:379255-82-0 Molecular Formula|379255-82-0 MDL|379255-82-0 SMILES|379255-82-0 4-(3-Nitro-benzylidene)-1,2,3,4-tetrahydro-acridine-9-carboxylic acid
Catalog No.: AA019GO6
379255-82-0,MFCD03147409
379255-82-0 | 4-(3-Nitro-benzylidene)-1,2,3,4-tetrahydro-acridine-9-carboxylic acid
This product is typically in stock,please click "Inquire" below or contact us at [email protected]for pricing and availability information.
Inquire
Technical Information
Catalog Number: AA019GO6
Chemical Name: 4-(3-Nitro-benzylidene)-1,2,3,4-tetrahydro-acridine-9-carboxylic acid
CAS Number: 379255-82-0
Molecular Formula: C21H16N2O4
Molecular Weight: 360.3627
MDL Number: MFCD03147409
SMILES: OC(=O)c1c2CCCC(=Cc3cccc(c3)[N+](=O)[O-])c2nc2c1cccc2
Properties
Complexity: 614  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 27  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 1  
XLogP3: 4.3  
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