methyl 2-(5-bromo-1H-indol-3-yl)-2-oxoacetate


Chemical Name: methyl 2-(5-bromo-1H-indol-3-yl)-2-oxoacetate
CAS Number: 163160-56-3
Product Number: AG001TTC(AGN-PC-0M79P8)
Synonyms:
MDL No:
Molecular Formula: C11H8BrNO3
Molecular Weight: 282.0901

Identification/Properties


Computed Properties
Molecular Weight:
282.093g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
280.969g/mol
Monoisotopic Mass:
280.969g/mol
Topological Polar Surface Area:
59.2A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
308
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#:
N/A
Hazard Statements:
H302-H317
Precautionary Statements:
P280
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback