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89504-55-2

89504-55-2 | Phosphonic acid, [4-(1-methylethyl)-1-piperazinyl]-, dimethyl ester

CAS No: 89504-55-2 Catalog No: AG0041U2 MDL No:

Product Description

Catalog Number:
AG0041U2
Chemical Name:
Phosphonic acid, [4-(1-methylethyl)-1-piperazinyl]-, dimethyl ester
CAS Number:
89504-55-2
Molecular Formula:
C9H21N2O3P
Molecular Weight:
236.2484
IUPAC Name:
1-dimethoxyphosphoryl-4-propan-2-ylpiperazine
InChI:
InChI=1S/C9H21N2O3P/c1-9(2)10-5-7-11(8-6-10)15(12,13-3)14-4/h9H,5-8H2,1-4H3
InChI Key:
YVUXQFVLVQLEOT-UHFFFAOYSA-N
SMILES:
COP(=O)(N1CCN(CC1)C(C)C)OC

Properties

Complexity:
232  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.129g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.252g/mol
Monoisotopic Mass:
236.129g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  

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