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21092-64-8 | 1-Propanone, 1-[5-methyl-2-[2-(4-morpholinyl)ethoxy]phenyl]-, hydrochloride (1:1)
CAS No: 21092-64-8 Catalog No: AG002L20 MDL No:
Product Description
Catalog Number:
AG002L20
Chemical Name:
1-Propanone, 1-[5-methyl-2-[2-(4-morpholinyl)ethoxy]phenyl]-, hydrochloride (1:1)
CAS Number:
21092-64-8
Molecular Formula:
C16H24ClNO3
Molecular Weight:
313.8197
IUPAC Name:
1-[5-methyl-2-(2-morpholin-4-ylethoxy)phenyl]propan-1-one;hydrochloride
InChI:
InChI=1S/C16H23NO3.ClH/c1-3-15(18)14-12-13(2)4-5-16(14)20-11-8-17-6-9-19-10-7-17;/h4-5,12H,3,6-11H2,1-2H3;1H
InChI Key:
YGKMZBGWLFBRQM-UHFFFAOYSA-N
SMILES:
CCC(=O)c1cc(C)ccc1OCCN1CCOCC1.Cl
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.144g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
313.822g/mol
Monoisotopic Mass:
313.144g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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