200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 94732-53-3
94732-53-3 | L-Alanine, N-[(5-nitro-1H-indol-3-yl)oxoacetyl]-
CAS No: 94732-53-3 Catalog No: AG006SCG MDL No:
Product Description
Catalog Number:
AG006SCG
Chemical Name:
L-Alanine, N-[(5-nitro-1H-indol-3-yl)oxoacetyl]-
CAS Number:
94732-53-3
Molecular Formula:
C13H11N3O6
Molecular Weight:
305.2429
IUPAC Name:
2-[[2-(5-nitro-1H-indol-3-yl)-2-oxoacetyl]amino]propanoic acid
InChI:
InChI=1S/C13H11N3O6/c1-6(13(19)20)15-12(18)11(17)9-5-14-10-3-2-7(16(21)22)4-8(9)10/h2-6,14H,1H3,(H,15,18)(H,19,20)
InChI Key:
MNFHAOVONLLVJN-UHFFFAOYSA-N
SMILES:
OC(=O)[C@@H](NC(=O)C(=O)c1c[nH]c2c1cc(cc2)[N+](=O)[O-])C
Properties
Complexity:
503
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.065g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
305.246g/mol
Monoisotopic Mass:
305.065g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
145A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.