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Home > Nitro Compounds > 86419-68-3
86419-68-3 | Ethanol, 2,2'-[(4-nitro-1,2-phenylene)diimino]bis-
CAS No: 86419-68-3 Catalog No: AG004XAY MDL No:
Product Description
Catalog Number:
AG004XAY
Chemical Name:
Ethanol, 2,2'-[(4-nitro-1,2-phenylene)diimino]bis-
CAS Number:
86419-68-3
Molecular Formula:
C10H15N3O4
Molecular Weight:
241.2438
IUPAC Name:
2-[2-(2-hydroxyethylamino)-4-nitroanilino]ethanol
InChI:
InChI=1S/C10H15N3O4/c14-5-3-11-9-2-1-8(13(16)17)7-10(9)12-4-6-15/h1-2,7,11-12,14-15H,3-6H2
InChI Key:
NUSJCPDAJSFPEZ-UHFFFAOYSA-N
SMILES:
OCCNc1cc(ccc1NCCO)[N+](=O)[O-]
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.106g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
241.247g/mol
Monoisotopic Mass:
241.106g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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