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76835-20-6 | Piperazine,1-(5-chloro-2-methylphenyl)-
CAS No: 76835-20-6 Catalog No: AG005HK1 MDL No:MFCD00087128
Product Description
Catalog Number:
AG005HK1
Chemical Name:
Piperazine,1-(5-chloro-2-methylphenyl)-
CAS Number:
76835-20-6
Molecular Formula:
C11H15ClN2
Molecular Weight:
210.7032
MDL Number:
MFCD00087128
IUPAC Name:
1-(5-chloro-2-methylphenyl)piperazine
InChI:
InChI=1S/C11H15ClN2/c1-9-2-3-10(12)8-11(9)14-6-4-13-5-7-14/h2-3,8,13H,4-7H2,1H3
InChI Key:
FVDJRHNUZNLRJC-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1N1CCNCC1)Cl
EC Number:
278-560-2
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.092g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
210.705g/mol
Monoisotopic Mass:
210.092g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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