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331445-27-3,MFCD00753662
Catalog No.:AA01EUWE

331445-27-3 | 2-([2-(4-dimethylamino-phenyl)-benzooxazol-5-yl-imino]-methyl)-4-nitro-phenol

This product is typically in stock,please click "Inquire" below or
contact us at [email protected] for pricing and availability information.
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA01EUWE
Chemical Name:
2-([2-(4-dimethylamino-phenyl)-benzooxazol-5-yl-imino]-methyl)-4-nitro-phenol
CAS Number:
331445-27-3
Molecular Formula:
C22H18N4O4
Molecular Weight:
402.4027
MDL Number:
MFCD00753662
SMILES:
Oc1ccc(cc1/C=N/c1ccc2c(c1)nc(o2)c1ccc(cc1)N(C)C)[N+](=O)[O-]
Properties
Computed Properties
 
Complexity:
617  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
4.3  

Literature
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SDS
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Tags:331445-27-3 Molecular Formula|331445-27-3 MDL|331445-27-3 SMILES|331445-27-3 2-([2-(4-dimethylamino-phenyl)-benzooxazol-5-yl-imino]-methyl)-4-nitro-phenol
Catalog No.: AA01EUWE
331445-27-3,MFCD00753662
331445-27-3 | 2-([2-(4-dimethylamino-phenyl)-benzooxazol-5-yl-imino]-methyl)-4-nitro-phenol
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: AA01EUWE
Chemical Name: 2-([2-(4-dimethylamino-phenyl)-benzooxazol-5-yl-imino]-methyl)-4-nitro-phenol
CAS Number: 331445-27-3
Molecular Formula: C22H18N4O4
Molecular Weight: 402.4027
MDL Number: MFCD00753662
SMILES: Oc1ccc(cc1/C=N/c1ccc2c(c1)nc(o2)c1ccc(cc1)N(C)C)[N+](=O)[O-]
Properties
Complexity: 617  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 30  
Hydrogen Bond Acceptor Count: 7  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 4.3  
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