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168299-26-1

168299-26-1 | 9H-Xanthen-9-one, 1,8-diethoxy-

CAS No: 168299-26-1 Catalog No: AG001XZN MDL No:

Product Description

Catalog Number:
AG001XZN
Chemical Name:
9H-Xanthen-9-one, 1,8-diethoxy-
CAS Number:
168299-26-1
Molecular Formula:
C17H16O4
Molecular Weight:
284.3065
IUPAC Name:
1,8-diethoxyxanthen-9-one
InChI:
InChI=1S/C17H16O4/c1-3-19-11-7-5-9-13-15(11)17(18)16-12(20-4-2)8-6-10-14(16)21-13/h5-10H,3-4H2,1-2H3
InChI Key:
UDGPKROUFHAURA-UHFFFAOYSA-N
SMILES:
CCOc1cccc2c1c(=O)c1c(o2)cccc1OCC

Properties

Complexity:
338  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.105g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.311g/mol
Monoisotopic Mass:
284.105g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  

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