Products
  • Products
  • Buy offers
  • Encyclopedia
  • Msds lib
  • Synthesis
  • Reach Info
  • Suppliers
Home> Hot Product Listed B   > BAS 07401765
1339236-05-3 structure

BAS 07401765

Iupac Name:1-(2,2,2-trifluoroethyl)azetidin-3-amine
CAS No.:1339236-05-3
Molecular Weight:154.136
Molecular Formula:C24H40N2O10 (isomer)
Names and Identifiers
Synonyms

8-((3-ethoxypropyl)amino)-3-methyl-7-(3-methylbenzyl)-1h-purine-2,6(3h,7h)-dione 8-(3-ethoxypropylamino)-3-methyl-7-[(3-methylphenyl)methyl]purine-2,6-dione 8-[(3-ethoxypropyl)amino]-3-methyl-7-(3-methylbenzyl)-3,7-dihydro-1h-purine-2,6-dione 8-[(3-ethoxypropyl)amino]-3-methyl-7-[(3-methylphenyl)methyl]-1,3,7-trihydropu rine-2,6-dione 8-[(3-ethoxypropyl)amino]-3-methyl-7-[(3-methylphenyl)methyl]-1h-purine-2,6-dione 8-[(3-ethoxypropyl)amino]-6-hydroxy-3-methyl-7-(3-methylbenzyl)-3,7-dihydro-2h-purin-2-one AC1MKEQD AKOS000722073 AKOS005486810 MCULE-7903021959 MOLPORT-000-750-045 MOLPORT-002-010-379 sr-01000365424 SR-01000365424-1 ST50026888 STK561165 STL008163 STOCK5S-85626 UPCMLD0ENAT5731004:001 ZINC2594263

Inchi
InChI=1S/C5H9F3N2/c6-5(7,8)3-10-1-4(9)2-10/h4H,1-3,9H2
InChkey
DXFBEMCYEOAHEK-UHFFFAOYSA-N
Canonical Smiles
C1C(CN1CC(F)(F)F)N
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:154.136g/mol
  • Molecular Formula:C24H40N2O10
  • Compound Is Canonicalized:True
  • Exact Mass:154.072
  • Monoisotopic Mass:154.072
  • Complexity:117
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:5
  • Topological Polar Surface Area:29.3A^2
  • Heavy Atom Count:10
  • 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: AAADccBjAYAAAAAAAAAAAAAAAABYAAAAAAAAAAAAAAAAAAAAAAAAHQAQAAAACCjBABQAAANAAAAA AAAAAAAAAAAAAAAAAIAIAAAAQAAAAAAUAAAAEACAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
Recommended Suppliers
Recommended Suppliers
 
<