Home Halogens 2-amino-2-(5-bromo-1H-indol-3-yl)acetic acid

2-amino-2-(5-bromo-1H-indol-3-yl)acetic acid

CAS No.:
1270311-06-2
Catalog Number:
AG01BIHB
Molecular Formula:
C10H9BrN2O2
Molecular Weight:
269.0947
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Product Description
Catalog Number:
AG01BIHB
Chemical Name:
2-amino-2-(5-bromo-1H-indol-3-yl)acetic acid
CAS Number:
1270311-06-2
Molecular Formula:
C10H9BrN2O2
Molecular Weight:
269.0947
MDL Number:
MFCD18655576
IUPAC Name:
2-amino-2-(5-bromo-1H-indol-3-yl)acetic acid
InChI:
InChI=1S/C10H9BrN2O2/c11-5-1-2-8-6(3-5)7(4-13-8)9(12)10(14)15/h1-4,9,13H,12H2,(H,14,15)
InChI Key:
RNOCAESBOHXJJT-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1c[nH]c2c1cc(Br)cc2)N
Properties
Complexity:
262  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.985g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
269.098g/mol
Monoisotopic Mass:
267.985g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
79.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9  
Properties