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115043-25-9

115043-25-9 | Ethanone, 2-(1-naphthalenyl)-1-(1-piperazinyl)-, hydrochloride (1:1)

CAS No: 115043-25-9 Catalog No: AG000FRE MDL No:

Product Description

Catalog Number:
AG000FRE
Chemical Name:
Ethanone, 2-(1-naphthalenyl)-1-(1-piperazinyl)-, hydrochloride (1:1)
CAS Number:
115043-25-9
Molecular Formula:
C16H19ClN2O
Molecular Weight:
290.7879
IUPAC Name:
2-naphthalen-1-yl-1-piperazin-1-ylethanone
InChI:
InChI=1S/C16H18N2O/c19-16(18-10-8-17-9-11-18)12-14-6-3-5-13-4-1-2-7-15(13)14/h1-7,17H,8-12H2
InChI Key:
FZTHQFULUIGZST-UHFFFAOYSA-N
SMILES:
O=C(N1CCNCC1)Cc1cccc2c1cccc2.Cl
UNII:
RX944JUD50

Properties

Complexity:
312  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.142g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
254.333g/mol
Monoisotopic Mass:
254.142g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  

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