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26383-58-4 | 1,2-Ethanediol, 1,2-bis(3-nitrobenzoate)
CAS No: 26383-58-4 Catalog No: AG002SXS MDL No:
Product Description
Catalog Number:
AG002SXS
Chemical Name:
1,2-Ethanediol, 1,2-bis(3-nitrobenzoate)
CAS Number:
26383-58-4
IUPAC Name:
2-(3-nitrobenzoyl)oxyethyl 3-nitrobenzoate
InChI:
InChI=1S/C16H12N2O8/c19-15(11-3-1-5-13(9-11)17(21)22)25-7-8-26-16(20)12-4-2-6-14(10-12)18(23)24/h1-6,9-10H,7-8H2
InChI Key:
UOQBSJPSIXUZDD-UHFFFAOYSA-N
NSC Number:
110356
Properties
Complexity:
493
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
360.059g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
360.278g/mol
Monoisotopic Mass:
360.059g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
144A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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