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139701-74-9 | Acetic acid, 2-phenoxy-, 2-[(2-phenoxyacetyl)amino]ethyl ester
CAS No: 139701-74-9 Catalog No: AG001BJA MDL No:
Product Description
Catalog Number:
AG001BJA
Chemical Name:
Acetic acid, 2-phenoxy-, 2-[(2-phenoxyacetyl)amino]ethyl ester
CAS Number:
139701-74-9
Molecular Formula:
C18H19NO5
Molecular Weight:
329.3472
IUPAC Name:
2-[(2-phenoxyacetyl)amino]ethyl 2-phenoxyacetate
InChI:
InChI=1S/C18H19NO5/c20-17(13-23-15-7-3-1-4-8-15)19-11-12-22-18(21)14-24-16-9-5-2-6-10-16/h1-10H,11-14H2,(H,19,20)
InChI Key:
IWZMAHOLEPBDNE-UHFFFAOYSA-N
SMILES:
O=C(COc1ccccc1)NCCOC(=O)COc1ccccc1
Properties
Complexity:
376
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.126g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
329.352g/mol
Monoisotopic Mass:
329.126g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
73.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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