Home Other Building Blocks 3-(1H-indol-3-ylformamido)propanoic acid

3-(1H-indol-3-ylformamido)propanoic acid

CAS No.:
171817-97-3
Catalog Number:
AG019UTE
Molecular Formula:
C12H12N2O3
Molecular Weight:
232.2353
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Product Description
Catalog Number:
AG019UTE
Chemical Name:
3-(1H-indol-3-ylformamido)propanoic acid
CAS Number:
171817-97-3
Molecular Formula:
C12H12N2O3
Molecular Weight:
232.2353
MDL Number:
MFCD09942044
IUPAC Name:
3-(1H-indole-3-carbonylamino)propanoic acid
InChI:
InChI=1S/C12H12N2O3/c15-11(16)5-6-13-12(17)9-7-14-10-4-2-1-3-8(9)10/h1-4,7,14H,5-6H2,(H,13,17)(H,15,16)
InChI Key:
UBZAIAYIGPMTIS-UHFFFAOYSA-N
SMILES:
OC(=O)CCNC(=O)c1c[nH]c2c1cccc2
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:
1.2  
Properties