Home Other Building Blocks 5-NITROBARBITURIC ACID HYDRATE 95

5-NITROBARBITURIC ACID HYDRATE 95

CAS No.:
209529-81-7
Catalog Number:
AG00BI4I
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00BI4I
Chemical Name:
5-NITROBARBITURIC ACID HYDRATE 95
CAS Number:
209529-81-7
MDL Number:
MFCD00160499
IUPAC Name:
5-nitro-1,3-diazinane-2,4,6-trione;hydrate
InChI:
InChI=1S/C4H3N3O5.H2O/c8-2-1(7(11)12)3(9)6-4(10)5-2;/h1H,(H2,5,6,8,9,10);1H2
InChI Key:
YKGZAIJTCJOZNK-UHFFFAOYSA-N
Properties
Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.018g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
191.099g/mol
Monoisotopic Mass:
191.018g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
122A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties