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Home> Encyclopedia > Hot Product Listed 6   > 6-Pteridinecarboxamide,4-amino-N-(2-methoxyethyl)-7-[(2-methoxyethyl)amino]-2-phenyl-
474688-73-8 structure

6-Pteridinecarboxamide,4-amino-N-(2-methoxyethyl)-7-[(2-methoxyethyl)amino]-2-phenyl-

Iupac Name:9-bromo-10-naphthalen-2-ylanthracene
CAS No.:474688-73-8
EINECS(EC#): 220-149-7
Molecular Weight:383.288
Molecular Formula:C19H12O (isomer)
Names and Identifiers
Synonyms

4-Amino-7-(2-methoxyethylamino)-N-(2-methoxyethyl)-2-phenyl-6-pteridinecarboxamide 4-Amino-N-(2-methoxyethyl)-7-(2-methoxyethylamino)-2-phenyl-6-pteridinecarboxamide Wy 5256

Inchi
InChI=1S/C24H15Br/c25-24-21-11-5-3-9-19(21)23(20-10-4-6-12-22(20)24)18-14-13-16-7-1-2-8-17(16)15-18/h1-15H
InChkey
FKIFDWYMWOJKTQ-UHFFFAOYSA-N
Canonical Smiles
C1=CC=C2C=C(C=CC2=C1)C3=C4C=CC=CC4=C(C5=CC=CC=C53)Br
Properties
Density
1.137
Boiling Point
324.7°C at 760 mmHg
Refractive Index
1.757
Flash Point
163.4°C
HS Code
2903999090
Safety and Handling
Safety

Poison by ingestion. When heated to decomposition it emits toxic fumes of NOx.

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 5gm/kg (5000mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 164, Pg. 11, 1966.
mouse LD50 oral 5010mg/kg (5010mg/kg)   Toxicology and Applied Pharmacology. Vol. 18, Pg. 185, 1971.
rat LD50 intramuscular > 5gm/kg (5000mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 164, Pg. 11, 1966.
rat LD50 oral 5010mg/kg (5010mg/kg)   Toxicology and Applied Pharmacology. Vol. 18, Pg. 185, 1971.

Specification

Removal in wastewater treatment of  4-Amino-N-(2-methoxyethyl)-7-((2-methoxyethyl)amino-2-phenyl)-6-pteridine-carboxamide  (CAS No.6504-77-4):
Total removal:1.96  percent
Total biodegradation:0.09  percent
Total sludge adsorption:1.87  percent
Total to air: 0.00  percent
(using 10000 hr Bio P,A,S)

MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s) no data available
Signal word

no data available

Hazard statement(s)

no data available

Precautionary statement(s)
Prevention

no data available

Response

no data available

Storage

no data available

Disposal

no data available

2.3 Other hazards which do not result in classification

no data available

Computational chemical data
  • Molecular Weight:383.288g/mol
  • Molecular Formula:C19H12O
  • Compound Is Canonicalized:True
  • Exact Mass:382.036
  • Monoisotopic Mass:382.036
  • Complexity:435
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:0
  • Topological Polar Surface Area:0A^2
  • Heavy Atom Count:25
  • 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
  • CACTVS Substructure Key Fingerprint: AAADccB4AAAAEAAAAAAAAAAAAAAAAAAAAAAwYMGDAAAAAADBVAAAGABAAAABrACAGAAwAMAAAACA AiBCAAACAAAgAAQIiAAAAKgIICKAERCAIAAggAAIihcAgMAOwgACEAAQgACEAAQgACEAAAAAAAAA AA==
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