Home Halogens 2-amino-3-(4-bromo-1H-indol-3-yl)propanoic acid hydrochloride

2-amino-3-(4-bromo-1H-indol-3-yl)propanoic acid hydrochloride

CAS No.:
1423024-39-8
Catalog Number:
AG01A2LL
Molecular Formula:
C11H12BrClN2O2
Molecular Weight:
319.5822
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Product Description
Catalog Number:
AG01A2LL
Chemical Name:
2-amino-3-(4-bromo-1H-indol-3-yl)propanoic acid hydrochloride
CAS Number:
1423024-39-8
Molecular Formula:
C11H12BrClN2O2
Molecular Weight:
319.5822
MDL Number:
MFCD22578643
IUPAC Name:
2-amino-3-(4-bromo-1H-indol-3-yl)propanoic acid;hydrochloride
InChI:
InChI=1S/C11H11BrN2O2.ClH/c12-7-2-1-3-9-10(7)6(5-14-9)4-8(13)11(15)16;/h1-3,5,8,14H,4,13H2,(H,15,16);1H
InChI Key:
SFXYTOLDAIQWCB-UHFFFAOYSA-N
SMILES:
OC(=O)C(Cc1c[nH]c2c1c(Br)ccc2)N.Cl
Properties
Complexity:
275  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.977g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
319.583g/mol
Monoisotopic Mass:
317.977g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
79.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties