1H-Indol-3-ol, 1-acetyl-5-bromo-, acetate (ester)


Chemical Name: 1H-Indol-3-ol, 1-acetyl-5-bromo-, acetate (ester)
CAS Number: 33588-54-4
Product Number: AG00BY8G(AGN-PC-0R932W)
Synonyms:
MDL No:
Molecular Formula: C12H10BrNO3
Molecular Weight: 296.1167

Identification/Properties


Properties
MP:
125-128 °C(lit.)
BP:
395.7°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Refractive Index:
1.6200 (estimate)
Computed Properties
Molecular Weight:
296.12g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
294.984g/mol
Monoisotopic Mass:
294.984g/mol
Topological Polar Surface Area:
48.3A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
334
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
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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