Home Aminos 4-(3-aminophenyl)-1,2,4-triazolidine-3,5-dione hydrochloride

4-(3-aminophenyl)-1,2,4-triazolidine-3,5-dione hydrochloride

CAS No.:
1803591-94-7
Catalog Number:
AG01BD7D
Molecular Formula:
C8H9ClN4O2
Molecular Weight:
228.6357
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Product Description
Catalog Number:
AG01BD7D
Chemical Name:
4-(3-aminophenyl)-1,2,4-triazolidine-3,5-dione hydrochloride
CAS Number:
1803591-94-7
Molecular Formula:
C8H9ClN4O2
Molecular Weight:
228.6357
MDL Number:
MFCD28023779
IUPAC Name:
4-(3-aminophenyl)-1,2,4-triazolidine-3,5-dione;hydrochloride
InChI:
InChI=1S/C8H8N4O2.ClH/c9-5-2-1-3-6(4-5)12-7(13)10-11-8(12)14;/h1-4H,9H2,(H,10,13)(H,11,14);1H
InChI Key:
OWPWKWMYZDKSPV-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)n1c(=O)[nH][nH]c1=O.Cl
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.041g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
228.636g/mol
Monoisotopic Mass:
228.041g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
87.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties