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Home Aldehydes Benzaldehyde, 2-(4-morpholinyl)-5-nitro-

Benzaldehyde, 2-(4-morpholinyl)-5-nitro-

CAS No.:
30742-62-2
Catalog Number:
AG00314G
Molecular Formula:
C11H12N2O4
Molecular Weight:
236.2240
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Product Description
Catalog Number:
AG00314G
Chemical Name:
Benzaldehyde, 2-(4-morpholinyl)-5-nitro-
CAS Number:
30742-62-2
Molecular Formula:
C11H12N2O4
Molecular Weight:
236.2240
MDL Number:
MFCD00439921
IUPAC Name:
2-morpholin-4-yl-5-nitrobenzaldehyde
InChI:
InChI=1S/C11H12N2O4/c14-8-9-7-10(13(15)16)1-2-11(9)12-3-5-17-6-4-12/h1-2,7-8H,3-6H2
InChI Key:
PCGDWIWUQDHQLK-UHFFFAOYSA-N
SMILES:
O=Cc1cc(ccc1N1CCOCC1)[N+](=O)[O-]
Properties
Complexity:
286  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.08g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.227g/mol
Monoisotopic Mass:
236.08g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties