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39512-51-1,MFCD00040729
Catalog No.:AA003CSJ
39512-51-1 | 1-(2-Methylphenyl)piperazine
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$35.00   $25.00
- +
5g
97%
in stock  
$69.00   $48.00
- +
25g
97%
in stock  
$264.00   $185.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003CSJ
Chemical Name:
1-(2-Methylphenyl)piperazine
CAS Number:
39512-51-1
Molecular Formula:
C11H16N2
Molecular Weight:
176.2581
MDL Number:
MFCD00040729
IUPAC Name:
1-(2-methylphenyl)piperazine
InChI:
InChI=1S/C11H16N2/c1-10-4-2-3-5-11(10)13-8-6-12-7-9-13/h2-5,12H,6-9H2,1H3
InChI Key:
WICKLEOONJPMEQ-UHFFFAOYSA-N
SMILES:
Cc1ccccc1N1CCNCC1
EC Number:
254-481-9
Properties
Computed Properties
 
Complexity:
152  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.131g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
176.263g/mol
Monoisotopic Mass:
176.131g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

Synonyms
 
1-(2-Methylphenyl)piperazine 
39512-51-1 
CHEMBL9746 
WICKLEOONJPMEQ-UHFFFAOYSA-N 
MFCD00040729 
(2-methylphenyl)piperazine 
1-(2-Methylphenyl)piperazine, 98% 
EINECS 254-481-9 
ACMC-209vxa 
1-(2-tolyl)piperazine 
N-(o-tolyl)-piperazine 
1-(o-tolyl) piperazine 
1-(o-Tolyl)piperazine 
2-methylphenyl-piperazine 
AC1Q1GNX 
AC1Q2NSK 
Maybridge4_000133 
AC1L3N5S 
SCHEMBL4896 
1-(2-Methylphenyl)piperazin 
1-(2-methyl phenyl) piperazine 
1-(2-methyl-phenyl)-piperazine 
CTK4I1454 
1-o-tolylpiperazine 
Piperazine,1-(2-methylphenyl)- 
ZINC66076 
DTXSID00192651 
ACN-S003822 
ACT03649 
ANW-45644 
BDBM50001903 
PDSP1_000005 
PDSP2_000005 
SBB071408 
2-Methylphenylpiperazine 
STL169115 
AKOS000101164 
FS-1234 
MCULE-7024130112 
RL03513 
TRA0031230 
VP70108 
IDI1_030715 
AJ-10182 
SC-21784 
4-(2-Methylphenyl)piperazine 
ST088479 
AB0024664 
DB-018453 
TC-060900 
FT-0605845 
ST24026958 
W5983 
Z-4210 
A824590 
L000837 
Piperazine, 1-(2-methylphenyl)- 
I14-7502 
J-503047 
F1905-7188 
1- piperazine 
C11H16N2 
CID91965 
NSC28784 
1-(o-Tolyl)piperazine hydrochloride 
AR-1F5956 
C11-H16-N2 
1-o-Tolyl-piperazine 
Piperazine, 1-(2-methylphenyl)- (9CI) 
T3404 
1-(2-Methylphenyl)piperazine, 98% - 1G 1g 
70849-60-4 
735-77-3 
1-(2-Methylphenyl)-piperazine 
o-tolylpiperazine 
Literature

Title: 4-(o-Tol-yl)piperazin-1-ium chloride.

Journal: Acta crystallographica. Section E, Structure reports online 20111101

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