Home Aldehydes 2-Amino-4-nitrobenzaldehyde

2-Amino-4-nitrobenzaldehyde

CAS No.:
109466-84-4
Catalog Number:
AG0096NI
Molecular Formula:
C7H6N2O3
Molecular Weight:
166.1341
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Product Description
Catalog Number:
AG0096NI
Chemical Name:
2-Amino-4-nitrobenzaldehyde
CAS Number:
109466-84-4
Molecular Formula:
C7H6N2O3
Molecular Weight:
166.1341
MDL Number:
MFCD01319035
IUPAC Name:
2-amino-4-nitrobenzaldehyde
InChI:
InChI=1S/C7H6N2O3/c8-7-3-6(9(11)12)2-1-5(7)4-10/h1-4H,8H2
InChI Key:
DKVANZONLCMNBC-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1N)[N+](=O)[O-]
Properties
Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.038g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
166.136g/mol
Monoisotopic Mass:
166.038g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
88.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties