Home Other Building Blocks 1-[3-(Methylthio)phenyl]piperazine

1-[3-(Methylthio)phenyl]piperazine

CAS No.:
76002-51-2
Catalog Number:
AG01FFX3
Molecular Formula:
C11H16N2S
Molecular Weight:
208.3231
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01FFX3
Chemical Name:
1-[3-(Methylthio)phenyl]piperazine
CAS Number:
76002-51-2
Molecular Formula:
C11H16N2S
Molecular Weight:
208.3231
MDL Number:
MFCD00129750
IUPAC Name:
1-(3-methylsulfanylphenyl)piperazine
InChI:
InChI=1S/C11H16N2S/c1-14-11-4-2-3-10(9-11)13-7-5-12-6-8-13/h2-4,9,12H,5-8H2,1H3
InChI Key:
XCMHZUWCZNJMKA-UHFFFAOYSA-N
SMILES:
CSc1cccc(c1)N1CCNCC1
Properties
Complexity:
169  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.103g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
208.323g/mol
Monoisotopic Mass:
208.103g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties