Home Other Building Blocks 1-(butan-2-yl)-1,3-diazinane-2,4-dione

1-(butan-2-yl)-1,3-diazinane-2,4-dione

CAS No.:
651718-04-6
Catalog Number:
AG019JIR
Molecular Formula:
C8H14N2O2
Molecular Weight:
170.2090
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Product Description
Catalog Number:
AG019JIR
Chemical Name:
1-(butan-2-yl)-1,3-diazinane-2,4-dione
CAS Number:
651718-04-6
Molecular Formula:
C8H14N2O2
Molecular Weight:
170.2090
MDL Number:
MFCD06357377
IUPAC Name:
1-butan-2-yl-1,3-diazinane-2,4-dione
InChI:
InChI=1S/C8H14N2O2/c1-3-6(2)10-5-4-7(11)9-8(10)12/h6H,3-5H2,1-2H3,(H,9,11,12)
InChI Key:
YWTPQCYJVYDSBA-UHFFFAOYSA-N
SMILES:
CC(N1CCC(=O)NC1=O)CC
Properties
Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.106g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
170.212g/mol
Monoisotopic Mass:
170.106g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties