1,3-bis[2-(4,5-dihy...

1,3-bis[2-(4,5-dihydro-1H-imidazol-2-yl)phenyl]urea 5374-54-9

1,3-bis[2-(4,5-dihydro-1H-imidazol-2-yl)phenyl]urea 5374-54-9

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1 Gram

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  • Min.Order :1 Gram
  • Purity: 99%
  • Payment Terms : L/C,T/T,

Keywords

1,3-bis[2-(4,5-dihydro-1H-imidazol-2-yl)phenyl]urea 5374-54-9 C19H20N6O

Quick Details

  • Appearance:Solid
  • Application:Organic Chemicals
  • PackAge:as requested
  • ProductionCapacity:100|Kilogram|Month
  • Storage:room temperature
  • Transportation:as requested

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Details:

Identification and Related Records
【Name】
IMIDOCARB
【Iupac name】
1,3-bis[2-(4,5-dihydro-1H-imidazol-2-yl)phenyl]urea
【CAS Registry number】
5374-54-9
【Synonyms】
1,3-bis[2-(4,5-dihydro-1H-imidazol-2-yl)phenyl]urea
【Molecular Formula】
C19H20N6O (Products with the same molecular formula)
【Molecular Weight】
348.4017
【Inchi】
InChI=1S/C19H20N6O/c26-19(24-15-7-3-1-5-13(15)17-20-9-10-21-17)25-16-8-4-2-6-14(16)18-22-11-12-23-18/h1-8H,9-12H2,(H,20,21)(H,22,23)(H2,24,25,26)
【InChIKey】
WLFUOMGYHMKOHP-UHFFFAOYSA-N
【Canonical SMILES】
C1CN=C(N1)C2=CC=CC=C2NC(=O)NC3=CC=CC=C3C4=NCCN4
Chemical and Physical Properties
【Density】
1.39g/cm3
【Boiling Point】
°Cat760mmHg
【Flash Point】
°C
【Computed Properties】
Molecular Weight:348.4017 [g/mol]
Molecular Formula:C19H20N6O
XLogP3-AA:0.4
H-Bond Donor:4
H-Bond Acceptor:3
Rotatable Bond Count:4
Tautomer Count:9
Exact Mass:348.169859
MonoIsotopic Mass:348.169859
Topological Polar Surface Area:89.9
Heavy Atom Count:26
Formal Charge:0
Complexity:526
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:1
Feature 3D Donor Count:4
Feature 3D Cation Count:2
Feature 3D Ring Count:4
Effective Rotor Count:7.2
Conformer Sampling RMSD:0.8
CID Conformer Count:11

 

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