(2S,3R,4S,5R)-2-[(5-bromo-4-chloro-1H-indol-3-yl)oxy]oxane-3,4,5-triol


Chemical Name: (2S,3R,4S,5R)-2-[(5-bromo-4-chloro-1H-indol-3-yl)oxy]oxane-3,4,5-triol
CAS Number: 207606-55-1
Product Number: AG002J5U(AGN-PC-0O7NP1)
Synonyms:
MDL No: MFCD00152013
Molecular Formula: C13H13BrClNO5
Molecular Weight: 378.6030

Identification/Properties


Computed Properties
Molecular Weight:
378.603g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
376.967g/mol
Monoisotopic Mass:
376.967g/mol
Topological Polar Surface Area:
94.9A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
379
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
4
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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