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1018660-87-1 | Benzeneacetic acid, α,α-dimethyl-4-(4-methyl-1-piperazinyl)-
CAS No: 1018660-87-1 Catalog No: AG0005SB MDL No:
Product Description
Catalog Number:
AG0005SB
Chemical Name:
Benzeneacetic acid, α,α-dimethyl-4-(4-methyl-1-piperazinyl)-
CAS Number:
1018660-87-1
Molecular Formula:
C15H22N2O2
Molecular Weight:
262.3474
IUPAC Name:
2-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]propanoic acid
InChI:
InChI=1S/C15H22N2O2/c1-15(2,14(18)19)12-4-6-13(7-5-12)17-10-8-16(3)9-11-17/h4-7H,8-11H2,1-3H3,(H,18,19)
InChI Key:
GVJVHNUSOGDLGU-UHFFFAOYSA-N
SMILES:
CN1CCN(CC1)c1ccc(cc1)C(C(=O)O)(C)C
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.168g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
262.353g/mol
Monoisotopic Mass:
262.168g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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