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13113-08-1

13113-08-1 | Glycine, N-[2-(1H-indol-3-yl)acetyl]-

CAS No: 13113-08-1 Catalog No: AG000VL3 MDL No:

Product Description

Catalog Number:
AG000VL3
Chemical Name:
Glycine, N-[2-(1H-indol-3-yl)acetyl]-
CAS Number:
13113-08-1
Molecular Formula:
C12H12N2O3
Molecular Weight:
232.2353
IUPAC Name:
2-[[2-(1H-indol-3-yl)acetyl]amino]acetic acid
InChI:
InChI=1S/C12H12N2O3/c15-11(14-7-12(16)17)5-8-6-13-10-4-2-1-3-9(8)10/h1-4,6,13H,5,7H2,(H,14,15)(H,16,17)
InChI Key:
YDXXLJMIHMIOIF-UHFFFAOYSA-N
SMILES:
O=C(Cc1c[nH]c2c1cccc2)NCC(=O)O

Properties

Complexity:
306  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.085g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
232.239g/mol
Monoisotopic Mass:
232.085g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
82.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  

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