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Home> Hot Product Listed T   > T6662367
59146-96-2 structure

T6662367

Iupac Name:2,3-dimethyl-6-nitroaniline
CAS No.:59146-96-2
Molecular Weight:166.1772
Molecular Formula:C17H24N2O3 (isomer)
Names and Identifiers
Synonyms

1-(2-ethoxyphenyl)-3-[(furan-3-yl)methyl]urea CHEMBL3452521 MCULE-5186950551 MOLPORT-009-059-730 Z432806742 ZINC47706075

Inchi
InChI=1/C8H10N2O2/c1-5-3-4-7(10(11)12)8(9)6(5)2/h3-4H,9H2,1-2H3
Canonical Smiles
CC1=C(C(=C(C=C1)[N+](=O)[O-])N)C
Properties
Melting Point
117-120 °C(lit.)
Refractive Index
1.601
Safety and Handling
Risk Statements
R20/21/22
Safety Statements
S26;S36
Transport
2811
Computational chemical data
  • Molecular Weight:166.1772g/mol
  • Molecular Formula:C17H24N2O3
  • Exact Mass:166.074228
  • Monoisotopic Mass:166.074228
  • Complexity:178
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:71.8
  • Heavy Atom Count:12
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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