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199672-04-3

199672-04-3 | Piperazine, 1-[(3-fluorophenyl)methyl]-, hydrochloride (1:2)

CAS No: 199672-04-3 Catalog No: AG002C9Q MDL No:MFCD08544426

Product Description

Catalog Number:
AG002C9Q
Chemical Name:
Piperazine, 1-[(3-fluorophenyl)methyl]-, hydrochloride (1:2)
CAS Number:
199672-04-3
Molecular Formula:
C11H17Cl2FN2
Molecular Weight:
267.1705
MDL Number:
MFCD08544426
IUPAC Name:
1-[(3-fluorophenyl)methyl]piperazine;dihydrochloride
InChI:
InChI=1S/C11H15FN2.2ClH/c12-11-3-1-2-10(8-11)9-14-6-4-13-5-7-14;;/h1-3,8,13H,4-7,9H2;2*1H
InChI Key:
BRNBEBNBUUJUPC-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1)CN1CCNCC1.Cl.Cl

Properties

Complexity:
169  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.075g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
267.169g/mol
Monoisotopic Mass:
266.075g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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