Home Nitros 3-(6-nitro-1H-indazol-1-yl)propanoic acid

3-(6-nitro-1H-indazol-1-yl)propanoic acid

CAS No.:
1016767-65-9
Catalog Number:
AG019UA6
Molecular Formula:
C10H9N3O4
Molecular Weight:
235.1962
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Product Description
Catalog Number:
AG019UA6
Chemical Name:
3-(6-nitro-1H-indazol-1-yl)propanoic acid
CAS Number:
1016767-65-9
Molecular Formula:
C10H9N3O4
Molecular Weight:
235.1962
MDL Number:
MFCD09807201
IUPAC Name:
3-(6-nitroindazol-1-yl)propanoic acid
InChI:
InChI=1S/C10H9N3O4/c14-10(15)3-4-12-9-5-8(13(16)17)2-1-7(9)6-11-12/h1-2,5-6H,3-4H2,(H,14,15)
InChI Key:
UXHLCFYVXHTHSO-UHFFFAOYSA-N
SMILES:
OC(=O)CCn1ncc2c1cc(cc2)[N+](=O)[O-]
Properties
Complexity:
317  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.059g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
235.199g/mol
Monoisotopic Mass:
235.059g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties