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1154916-98-9 | Methyl 3-(4-Acetylpiperazin-1-yl)-2-methyl propanoate
CAS No: 1154916-98-9 Catalog No: AG01F85U MDL No:MFCD12193173
Product Description
Catalog Number:
AG01F85U
Chemical Name:
Methyl 3-(4-Acetylpiperazin-1-yl)-2-methyl propanoate
CAS Number:
1154916-98-9
Molecular Formula:
C11H20N2O3
Molecular Weight:
228.2881
MDL Number:
MFCD12193173
IUPAC Name:
methyl 3-(4-acetylpiperazin-1-yl)-2-methylpropanoate
InChI:
InChI=1S/C11H20N2O3/c1-9(11(15)16-3)8-12-4-6-13(7-5-12)10(2)14/h9H,4-8H2,1-3H3
InChI Key:
OWCGAEIJJWGBSQ-UHFFFAOYSA-N
SMILES:
COC(=O)C(CN1CCN(CC1)C(=O)C)C
Properties
Complexity:
260
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.147g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.292g/mol
Monoisotopic Mass:
228.147g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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