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1865007-03-9 | 2-(ethylamino)-5-nitrobenzaldehyde
CAS No: 1865007-03-9 Catalog No: AG01BT31 MDL No:MFCD01016952
Product Description
Catalog Number:
AG01BT31
Chemical Name:
2-(ethylamino)-5-nitrobenzaldehyde
CAS Number:
1865007-03-9
Molecular Formula:
C9H10N2O3
Molecular Weight:
194.1873
MDL Number:
MFCD01016952
IUPAC Name:
2-(ethylamino)-5-nitrobenzaldehyde
InChI:
InChI=1S/C9H10N2O3/c1-2-10-9-4-3-8(11(13)14)5-7(9)6-12/h3-6,10H,2H2,1H3
InChI Key:
NEAJDJOHJXDZFN-UHFFFAOYSA-N
SMILES:
CCNc1ccc(cc1C=O)[N+](=O)[O-]
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.069g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
194.19g/mol
Monoisotopic Mass:
194.069g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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