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1605772-63-1 | Ethanone, 2-amino-1-[4-(2-fluorophenyl)-1-piperazinyl]-, hydrochloride (1:2)
CAS No: 1605772-63-1 Catalog No: AG001S15 MDL No:MFCD28041366
Product Description
Catalog Number:
AG001S15
Chemical Name:
Ethanone, 2-amino-1-[4-(2-fluorophenyl)-1-piperazinyl]-, hydrochloride (1:2)
CAS Number:
1605772-63-1
Molecular Formula:
C12H18Cl2FN3O
Molecular Weight:
310.1952
MDL Number:
MFCD28041366
IUPAC Name:
2-amino-1-[4-(2-fluorophenyl)piperazin-1-yl]ethanone;hydrochloride
InChI:
InChI=1S/C12H16FN3O.ClH/c13-10-3-1-2-4-11(10)15-5-7-16(8-6-15)12(17)9-14;/h1-4H,5-9,14H2;1H
InChI Key:
HAAWAYOMAGSNEO-UHFFFAOYSA-N
SMILES:
NCC(=O)N1CCN(CC1)c1ccccc1F.Cl.Cl
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.104g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
273.736g/mol
Monoisotopic Mass:
273.104g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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