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19779-55-6 | 4-Morpholineacetic acid, 2-(4-hydroxy-3-methoxyphenyl)-2-oxoethyl ester
CAS No: 19779-55-6 Catalog No: AG002B0P MDL No:
Product Description
Catalog Number:
AG002B0P
Chemical Name:
4-Morpholineacetic acid, 2-(4-hydroxy-3-methoxyphenyl)-2-oxoethyl ester
CAS Number:
19779-55-6
Molecular Formula:
C15H19NO6
Molecular Weight:
309.3145
IUPAC Name:
[2-(4-hydroxy-3-methoxyphenyl)-2-oxoethyl] 2-morpholin-4-ylacetate
InChI:
InChI=1S/C15H19NO6/c1-20-14-8-11(2-3-12(14)17)13(18)10-22-15(19)9-16-4-6-21-7-5-16/h2-3,8,17H,4-7,9-10H2,1H3
InChI Key:
VLZUHNAJSYDBKG-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1O)C(=O)COC(=O)CN1CCOCC1
Properties
Complexity:
382
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.121g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
309.318g/mol
Monoisotopic Mass:
309.121g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
85.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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