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Home > Nitro Compounds > 1240580-66-8

1240580-66-8

1240580-66-8 | 2-methyl-1-(4-nitrophenyl)piperazine

CAS No: 1240580-66-8 Catalog No: AG00JVCT MDL No:MFCD16811355

Product Description

Catalog Number:
AG00JVCT
Chemical Name:
2-methyl-1-(4-nitrophenyl)piperazine
CAS Number:
1240580-66-8
Molecular Formula:
C11H15N3O2
Molecular Weight:
221.2557
MDL Number:
MFCD16811355
IUPAC Name:
2-methyl-1-(4-nitrophenyl)piperazine
InChI:
InChI=1S/C11H15N3O2/c1-9-8-12-6-7-13(9)10-2-4-11(5-3-10)14(15)16/h2-5,9,12H,6-8H2,1H3
InChI Key:
MSOLFNXBYZHSKJ-UHFFFAOYSA-N
SMILES:
CC1CNCCN1c1ccc(cc1)[N+](=O)[O-]

Properties

Complexity:
246  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.116g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.26g/mol
Monoisotopic Mass:
221.116g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
61.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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