Home Other Building Blocks 5-ISOPROPYLBARBITURIC ACID

5-ISOPROPYLBARBITURIC ACID

CAS No.:
7391-69-7
Catalog Number:
AG003MTM
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG003MTM
Chemical Name:
5-ISOPROPYLBARBITURIC ACID
CAS Number:
7391-69-7
MDL Number:
MFCD00051832
IUPAC Name:
5-propan-2-yl-1,3-diazinane-2,4,6-trione
InChI:
InChI=1S/C7H10N2O3/c1-3(2)4-5(10)8-7(12)9-6(4)11/h3-4H,1-2H3,(H2,8,9,10,11,12)
InChI Key:
GFPIGNBQTXNNAG-UHFFFAOYSA-N
EC Number:
230-982-8
NSC Number:
66909
Properties
Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.069g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
170.168g/mol
Monoisotopic Mass:
170.069g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
75.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties