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Home > Indoles and Oxindole > 1167055-52-8
1167055-52-8 | 1H-Indole-2,3-dione, 7-methoxy-5-(phenylmethoxy)-
CAS No: 1167055-52-8 Catalog No: AG000D0Z MDL No:
Product Description
Catalog Number:
AG000D0Z
Chemical Name:
1H-Indole-2,3-dione, 7-methoxy-5-(phenylmethoxy)-
CAS Number:
1167055-52-8
Molecular Formula:
C16H13NO4
Molecular Weight:
283.2787
IUPAC Name:
7-methoxy-5-phenylmethoxy-1H-indole-2,3-dione
InChI:
InChI=1S/C16H13NO4/c1-20-13-8-11(21-9-10-5-3-2-4-6-10)7-12-14(13)17-16(19)15(12)18/h2-8H,9H2,1H3,(H,17,18,19)
InChI Key:
RHAXQCWXCQMIFK-UHFFFAOYSA-N
SMILES:
COc1cc(OCc2ccccc2)cc2c1NC(=O)C2=O
Properties
Complexity:
405
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:
1
Isotope Atom Count:
0
Molecular Weight:
283.283g/mol
Monoisotopic Mass:
283.084g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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