Home Other Building Blocks lithium 2-[(4-methylpiperazin-1-yl)methyl]benzoate

lithium 2-[(4-methylpiperazin-1-yl)methyl]benzoate

CAS No.:
915707-44-7
Catalog Number:
AG00GVED
Molecular Formula:
C13H17LiN2O2
Molecular Weight:
240.2273
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Product Description
Catalog Number:
AG00GVED
Chemical Name:
lithium 2-[(4-methylpiperazin-1-yl)methyl]benzoate
CAS Number:
915707-44-7
Molecular Formula:
C13H17LiN2O2
Molecular Weight:
240.2273
MDL Number:
MFCD09064954
IUPAC Name:
lithium;2-[(4-methylpiperazin-1-yl)methyl]benzoate
InChI:
InChI=1S/C13H18N2O2.Li/c1-14-6-8-15(9-7-14)10-11-4-2-3-5-12(11)13(16)17;/h2-5H,6-10H2,1H3,(H,16,17);/q;+1/p-1
InChI Key:
BHMRBFXQIGCNNV-UHFFFAOYSA-M
SMILES:
CN1CCN(CC1)Cc1ccccc1C(=O)[O-].[Li+]
Properties
Complexity:
268  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.145g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.231g/mol
Monoisotopic Mass:
240.145g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties