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Home > Nitro Compounds > 855223-18-6
855223-18-6 | N-(7,8-dinitro-2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
CAS No: 855223-18-6 Catalog No: AG00JD1W MDL No:MFCD18064632
Product Description
Catalog Number:
AG00JD1W
Chemical Name:
N-(7,8-dinitro-2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
CAS Number:
855223-18-6
Molecular Formula:
C10H9N3O7
Molecular Weight:
283.1944
MDL Number:
MFCD18064632
IUPAC Name:
N-(5,6-dinitro-2,3-dihydro-1,4-benzodioxin-7-yl)acetamide
InChI:
InChI=1S/C10H9N3O7/c1-5(14)11-6-4-7-10(20-3-2-19-7)9(13(17)18)8(6)12(15)16/h4H,2-3H2,1H3,(H,11,14)
InChI Key:
PBSAFZNQZDBRJP-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1cc2OCCOc2c(c1[N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
418
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.044g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
283.196g/mol
Monoisotopic Mass:
283.044g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
139A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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