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Home > Indoles and Oxindole > 2014-61-1
2014-61-1 | 1H-Isoindole-1,3(2H)-dione, 2-[(4-methoxyphenyl)methoxy]-
CAS No: 2014-61-1 Catalog No: AG002DE5 MDL No:
Product Description
Catalog Number:
AG002DE5
Chemical Name:
1H-Isoindole-1,3(2H)-dione, 2-[(4-methoxyphenyl)methoxy]-
CAS Number:
2014-61-1
Molecular Formula:
C16H13NO4
Molecular Weight:
283.2787
IUPAC Name:
2-[(4-methoxyphenyl)methoxy]isoindole-1,3-dione
InChI:
InChI=1S/C16H13NO4/c1-20-12-8-6-11(7-9-12)10-21-17-15(18)13-4-2-3-5-14(13)16(17)19/h2-9H,10H2,1H3
InChI Key:
HKVUKOYOPFEIBG-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)CON1C(=O)c2c(C1=O)cccc2
Properties
Complexity:
379
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.084g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.283g/mol
Monoisotopic Mass:
283.084g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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