Home Aminos 1-Benzyl-4-(4-aminobutyl)piperazine

1-Benzyl-4-(4-aminobutyl)piperazine

CAS No.:
4487-05-2
Catalog Number:
AG00DBPU
Molecular Formula:
C15H25N3
Molecular Weight:
247.3791
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Product Description
Catalog Number:
AG00DBPU
Chemical Name:
1-Benzyl-4-(4-aminobutyl)piperazine
CAS Number:
4487-05-2
Molecular Formula:
C15H25N3
Molecular Weight:
247.3791
MDL Number:
MFCD09723558
IUPAC Name:
4-(4-benzylpiperazin-1-yl)butan-1-amine
InChI:
InChI=1S/C15H25N3/c16-8-4-5-9-17-10-12-18(13-11-17)14-15-6-2-1-3-7-15/h1-3,6-7H,4-5,8-14,16H2
InChI Key:
CELVPVTXKMNJMA-UHFFFAOYSA-N
SMILES:
NCCCCN1CCN(CC1)Cc1ccccc1
Properties
Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.205g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
247.386g/mol
Monoisotopic Mass:
247.205g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
32.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties