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Home > Nitro Compounds > 2782-38-9

2782-38-9

2782-38-9 | BenzaMide, N,N-diethyl-3,5-dinitro-

CAS No: 2782-38-9 Catalog No: AG002UV1 MDL No:

Product Description

Catalog Number:
AG002UV1
Chemical Name:
BenzaMide, N,N-diethyl-3,5-dinitro-
CAS Number:
2782-38-9
Molecular Formula:
C11H13N3O5
Molecular Weight:
267.2380
IUPAC Name:
N,N-diethyl-3,5-dinitrobenzamide
InChI:
InChI=1S/C11H13N3O5/c1-3-12(4-2)11(15)8-5-9(13(16)17)7-10(6-8)14(18)19/h5-7H,3-4H2,1-2H3
InChI Key:
BQWBSYSXEQYXJI-UHFFFAOYSA-N
SMILES:
CCN(C(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])CC

Properties

Complexity:
336  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.086g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.241g/mol
Monoisotopic Mass:
267.086g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

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