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10001-08-8

10001-08-8 | 1-Hexanone, 1-(4-methyl-1-piperazinyl)-

CAS No: 10001-08-8 Catalog No: AG0000AS MDL No:

Product Description

Catalog Number:
AG0000AS
Chemical Name:
1-Hexanone, 1-(4-methyl-1-piperazinyl)-
CAS Number:
10001-08-8
Molecular Formula:
C11H22N2O
Molecular Weight:
198.3052
IUPAC Name:
1-(4-methylpiperazin-1-yl)hexan-1-one
InChI:
InChI=1S/C11H22N2O/c1-3-4-5-6-11(14)13-9-7-12(2)8-10-13/h3-10H2,1-2H3
InChI Key:
TUBDWOUHWWRXLI-UHFFFAOYSA-N
SMILES:
CCCCCC(=O)N1CCN(CC1)C

Properties

Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.173g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.31g/mol
Monoisotopic Mass:
198.173g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
23.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  

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