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Home Nitros N-Ethyl-2-nitroaniline

N-Ethyl-2-nitroaniline

CAS No.:
10112-15-9
Catalog Number:
AG0003SE
Molecular Formula:
C8H10N2O2
Molecular Weight:
166.1772
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$78
- +
5g
98%
In Stock USA
United States
$232
- +
10g
98%
In Stock USA
United States
$424
- +
25g
98%
In Stock USA
United States
$813
- +
Product Description
Catalog Number:
AG0003SE
Chemical Name:
N-Ethyl-2-nitroaniline
CAS Number:
10112-15-9
Molecular Formula:
C8H10N2O2
Molecular Weight:
166.1772
MDL Number:
MFCD00007091
IUPAC Name:
N-ethyl-2-nitroaniline
InChI:
InChI=1S/C8H10N2O2/c1-2-9-7-5-3-4-6-8(7)10(11)12/h3-6,9H,2H2,1H3
InChI Key:
CQIKVOWCSGXCCG-UHFFFAOYSA-N
SMILES:
CCNc1ccccc1[N+](=O)[O-]
EC Number:
233-305-4
Properties
Complexity:
156  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.074g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
166.18g/mol
Monoisotopic Mass:
166.074g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Literature
Title Journal
N,N'-diethyl-4-nitrobenzene-1,3-diamine, 2,6-bis(ethylamino)-3-nitrobenzonitrile and bis(4-ethylamino-3-nitrophenyl) sulfone. Acta crystallographica. Section C, Crystal structure communications 20100701
Properties