Home Other Building Blocks 1-phenyl-4-(prop-2-yn-1-yl)piperazine

1-phenyl-4-(prop-2-yn-1-yl)piperazine

CAS No.:
21057-45-4
Catalog Number:
AG01BBKH
Molecular Formula:
C13H16N2
Molecular Weight:
200.2795
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Product Description
Catalog Number:
AG01BBKH
Chemical Name:
1-phenyl-4-(prop-2-yn-1-yl)piperazine
CAS Number:
21057-45-4
Molecular Formula:
C13H16N2
Molecular Weight:
200.2795
MDL Number:
MFCD14631354
IUPAC Name:
1-phenyl-4-prop-2-ynylpiperazine
InChI:
InChI=1S/C13H16N2/c1-2-8-14-9-11-15(12-10-14)13-6-4-3-5-7-13/h1,3-7H,8-12H2
InChI Key:
HXCMCQTZVAVXOZ-UHFFFAOYSA-N
SMILES:
C#CCN1CCN(CC1)c1ccccc1
Properties
Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.131g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.285g/mol
Monoisotopic Mass:
200.131g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
6.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties