Products
  • Products
  • Buy offers
  • Encyclopedia
  • Msds lib
  • Synthesis
  • Reach Info
  • Suppliers
Home> Encyclopedia > Hot Product Listed 6   > 6H-Purin-6-one,1,5-dihydro-2-methyl-
1956-39-4 structure

6H-Purin-6-one,1,5-dihydro-2-methyl-

Iupac Name:(NZ)-N-[1-(4-chlorophenyl)ethylidene]hydroxylamine
CAS No.:1956-39-4
Molecular Weight:169.60822
Molecular Formula:C5H4N4O (isomer)
Names and Identifiers
Synonyms

2-methyl-1,5-dihydropurin-6-one 2-methyl-1h-purin-6(5h)-one 6h-purin-6-one, 1,5-dihydro-2-methyl- (9ci) AK435789 AKOS027396755

Inchi
InChI=1/C8H8ClNO/c1-6(10-11)7-2-4-8(9)5-3-7/h2-5,11H,1H3/b10-6-
Canonical Smiles
CC(=NO)C1=CC=C(C=C1)Cl
Isomers Smiles
C/C(=N/O)/C1=CC=C(C=C1)Cl
Properties
Density
1.349
Melting Point
96-98°C
Vapour
0.00246mmHg at 25°C
Refractive Index
1.543
HS Code
2928000090
Safety and Handling
HazardClass
IRRITANT
Computational chemical data
  • Molecular Weight:169.60822g/mol
  • Molecular Formula:C5H4N4O
  • Exact Mass:169.029442
  • Monoisotopic Mass:169.029442
  • Complexity:150
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:2
  • Topological Polar Surface Area:32.6
  • Heavy Atom Count:11
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:1
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
Recommended Suppliers
  • Tel:0086-531-58773055
  • Fax:0086-531-58773066
  • Tel:+49 (0) 202 4690049
  • Fax:+49 (0) 202 4690048
 
<