Home Halogens ethyl 2-amino-2-(5-bromo-1H-indol-3-yl)acetate

ethyl 2-amino-2-(5-bromo-1H-indol-3-yl)acetate

CAS No.:
1888488-93-4
Catalog Number:
AG01ELGQ
Molecular Formula:
C12H13BrN2O2
Molecular Weight:
297.1478
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Product Description
Catalog Number:
AG01ELGQ
Chemical Name:
ethyl 2-amino-2-(5-bromo-1H-indol-3-yl)acetate
CAS Number:
1888488-93-4
Molecular Formula:
C12H13BrN2O2
Molecular Weight:
297.1478
MDL Number:
MFCD31617113
IUPAC Name:
ethyl 2-amino-2-(5-bromo-1H-indol-3-yl)acetate
InChI:
InChI=1S/C12H13BrN2O2/c1-2-17-12(16)11(14)9-6-15-10-4-3-7(13)5-8(9)10/h3-6,11,15H,2,14H2,1H3
InChI Key:
AKHHHJINARUKLZ-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(c1c[nH]c2c1cc(Br)cc2)N
Properties
Complexity:
288  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.016g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
297.152g/mol
Monoisotopic Mass:
296.016g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
68.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties