Home Other Building Blocks 1-(3-Methylbenzyl)piperazine

1-(3-Methylbenzyl)piperazine

CAS No.:
5321-48-2
Catalog Number:
AG003CXI
Molecular Formula:
C12H18N2
Molecular Weight:
190.2847
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$19
- +
5g
98%
In Stock USA
United States
$57
- +
25g
98%
In Stock USA
United States
$200
- +
100g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG003CXI
Chemical Name:
1-(3-Methylbenzyl)piperazine
CAS Number:
5321-48-2
Molecular Formula:
C12H18N2
Molecular Weight:
190.2847
MDL Number:
MFCD01321003
IUPAC Name:
1-[(3-methylphenyl)methyl]piperazine
InChI:
InChI=1S/C12H18N2/c1-11-3-2-4-12(9-11)10-14-7-5-13-6-8-14/h2-4,9,13H,5-8,10H2,1H3
InChI Key:
VTEOTZPEMDQENX-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)CN1CCNCC1
EC Number:
226-184-4
NSC Number:
30681
Properties
Complexity:
164  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.147g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
190.29g/mol
Monoisotopic Mass:
190.147g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties