Home Halogens 2-Amino-3-(7-chloro-1H-indol-3-yl)propanoic acid (hydrochloride)

2-Amino-3-(7-chloro-1H-indol-3-yl)propanoic acid (hydrochloride)

CAS No.:
2070014-72-9
Catalog Number:
AG01CCUY
Molecular Formula:
C11H12Cl2N2O2
Molecular Weight:
275.1312
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Product Description
Catalog Number:
AG01CCUY
Chemical Name:
2-Amino-3-(7-chloro-1H-indol-3-yl)propanoic acid (hydrochloride)
CAS Number:
2070014-72-9
Molecular Formula:
C11H12Cl2N2O2
Molecular Weight:
275.1312
MDL Number:
MFCD26960557
IUPAC Name:
2-amino-3-(7-chloro-1H-indol-3-yl)propanoic acid;hydrochloride
InChI:
InChI=1S/C11H11ClN2O2.ClH/c12-8-3-1-2-7-6(5-14-10(7)8)4-9(13)11(15)16;/h1-3,5,9,14H,4,13H2,(H,15,16);1H
InChI Key:
NSRKGSISAZLLDC-UHFFFAOYSA-N
SMILES:
NC(C(=O)O)Cc1c[nH]c2c1cccc2Cl.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:
274.028g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
275.129g/mol
Monoisotopic Mass:
274.028g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
79.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties