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116046-92-5

116046-92-5 | Pyrimidine, 1,3-bis(2,2-dimethyl-1-oxopropyl)hexahydro- (9CI)

CAS No: 116046-92-5 Catalog No: AG000BHN MDL No:

Product Description

Catalog Number:
AG000BHN
Chemical Name:
Pyrimidine, 1,3-bis(2,2-dimethyl-1-oxopropyl)hexahydro- (9CI)
CAS Number:
116046-92-5
Molecular Formula:
C14H26N2O2
Molecular Weight:
254.3684
IUPAC Name:
1-[3-(2,2-dimethylpropanoyl)-1,3-diazinan-1-yl]-2,2-dimethylpropan-1-one
InChI:
InChI=1S/C14H26N2O2/c1-13(2,3)11(17)15-8-7-9-16(10-15)12(18)14(4,5)6/h7-10H2,1-6H3
InChI Key:
BIYNBZHGHRIYPI-UHFFFAOYSA-N
SMILES:
O=C(C(C)(C)C)N1CCCN(C1)C(=O)C(C)(C)C

Properties

Complexity:
305  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.199g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.374g/mol
Monoisotopic Mass:
254.199g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

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