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Home > Other Building Blocks > 89216-93-3
89216-93-3 | 9H-Xanthene-3-carbonyl chloride, 7-ethoxy-9-oxo-
CAS No: 89216-93-3 Catalog No: AG0044Z3 MDL No:
Product Description
Catalog Number:
AG0044Z3
Chemical Name:
9H-Xanthene-3-carbonyl chloride, 7-ethoxy-9-oxo-
CAS Number:
89216-93-3
Molecular Formula:
C16H11ClO4
Molecular Weight:
302.7091
IUPAC Name:
7-ethoxy-9-oxoxanthene-3-carbonyl chloride
InChI:
InChI=1S/C16H11ClO4/c1-2-20-10-4-6-13-12(8-10)15(18)11-5-3-9(16(17)19)7-14(11)21-13/h3-8H,2H2,1H3
InChI Key:
WLINFVNWOXIYLQ-UHFFFAOYSA-N
SMILES:
CCOc1ccc2c(c1)c(=O)c1c(o2)cc(cc1)C(=O)Cl
Properties
Complexity:
425
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.035g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.71g/mol
Monoisotopic Mass:
302.035g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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