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Home > Nitro Compounds > 476428-03-2
476428-03-2 | ethyl N-[(2,2-dinitroacetamido)carbonyl]carbamate
CAS No: 476428-03-2 Catalog No: AG01F9DM MDL No:
Product Description
Catalog Number:
AG01F9DM
Chemical Name:
ethyl N-[(2,2-dinitroacetamido)carbonyl]carbamate
CAS Number:
476428-03-2
Molecular Formula:
C6H8N4O8
Molecular Weight:
264.1497
IUPAC Name:
ethyl N-[(2,2-dinitroacetyl)carbamoyl]carbamate
InChI:
InChI=1S/C6H8N4O8/c1-2-18-6(13)8-5(12)7-3(11)4(9(14)15)10(16)17/h4H,2H2,1H3,(H2,7,8,11,12,13)
InChI Key:
VHQWFGJRHKEBKQ-UHFFFAOYSA-N
SMILES:
CCOC(=O)NC(=O)NC(=O)C([N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
368
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.034g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
264.15g/mol
Monoisotopic Mass:
264.034g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
176A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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