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1146411-40-6 | 2-Piperazinone, 1-(2-chlorophenyl)-, hydrochloride (1:1)
CAS No: 1146411-40-6 Catalog No: AG000EWA MDL No:MFCD09027309
Product Description
Catalog Number:
AG000EWA
Chemical Name:
2-Piperazinone, 1-(2-chlorophenyl)-, hydrochloride (1:1)
CAS Number:
1146411-40-6
Molecular Formula:
C10H12Cl2N2O
Molecular Weight:
247.1211
MDL Number:
MFCD09027309
IUPAC Name:
1-(2-chlorophenyl)piperazin-2-one;hydrochloride
InChI:
InChI=1S/C10H11ClN2O.ClH/c11-8-3-1-2-4-9(8)13-6-5-12-7-10(13)14;/h1-4,12H,5-7H2;1H
InChI Key:
YMQUNAVTMUSZFS-UHFFFAOYSA-N
SMILES:
O=C1CNCCN1c1ccccc1Cl.Cl
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.033g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
247.119g/mol
Monoisotopic Mass:
246.033g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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