Product Name

  • Name

    4,5-b]difuran-4-yl)-2-amino

  • EINECS
  • CAS No. 502759-67-3
  • Density
  • Solubility
  • Melting Point
  • Formula C13H12BrNO2
  • Boiling Point
  • Molecular Weight 294.14
  • Flash Point
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 502759-67-3 (4,5-b]difuran-4-yl)-2-amino)
  • Hazard Symbols
  • Synonyms Bromo-DragonFLY;1-(4-Bromofuro(2,3-f)(1)benzofuran-8-yl)propan-2-amine;
  • PSA 52.30000
  • LogP 4.53150

(1-(8-Bromobenzo[1,2-b;4,5-b]difuran-4-yl)-2-aminopropane Specification

The (1-(8-Bromobenzo[1,2-b;4,5-b]difuran-4-yl)-2-aminopropane, with the CAS registry number 502759-67-3,is also known as Bromodragonfly. It belongs to the product categories of Organic matters. This chemical's molecular formula is C13H12BrNO2 and molecular weight is 293.005127 . What's more,Its systematic name is (1-(8-Bromobenzo[1,2-b;4,5-b]difuran-4-yl)-2-aminopropane. It is fatal poisoning reported with this potent hallucinogenic drug.

Physical properties about (1-(8-Bromobenzo[1,2-b;4,5-b]difuran-4-yl)-2-aminopropane are:
(1)ACD/LogP:  3.481; (2)# of Rule of 5 Violations:  0; (3)ACD/LogD (pH 5.5):  0.52; (4)ACD/LogD (pH 7.4):  1.85; (5)ACD/BCF (pH 5.5):  1.00; (6)ACD/BCF (pH 7.4):  6.08; (7)ACD/KOC (pH 5.5):  2.02; (8)ACD/KOC (pH 7.4):  43.52; (9)#H bond acceptors:  3; (10)#H bond donors:  2; (11)#Freely Rotating Bonds:  3; (12)Polar Surface Area:  52.3 ?2; (13)Index of Refraction:  1.669; (14)Molar Refractivity:  71.903 cm3; (15)Molar Volume:  192.817 cm3; (16)Polarizability:  28.505 10-24cm3 ; (17)Surface Tension:  51.3639984130859 dyne/cm; (18)Density:  1.525 g/cm3; (19)Flash Point:  189.764 °C; (20)Enthalpy of Vaporization:  63.96 kJ/mol; (21)Boiling Point:  390.163 °C at 760 mmHg; (22)Vapour Pressure:  0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES:Brc3c1ccoc1c(c2c3occ2)C[C@H](N)C;
(2)Std. InChI:InChI=1S/C13H12BrNO2/c1-7(15)6-10-8-2-4-17-13(8)11(14)9-3-5-16-12(9)10/h2-5,7H,6,15H2,1H3/t7-/m1/s1;
(3)Std. InChIKey:GIKPTWKWYXCBEC-SSDOTTSWSA-N.

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