200,000+ products from a single source!
sales@angenechem.com
89216-75-1 | 9H-Xanthene-3-carboxylic acid, 7-ethoxy-9-oxo-, methyl ester
CAS No: 89216-75-1 Catalog No: AG00460D MDL No:
Product Description
Catalog Number:
AG00460D
Chemical Name:
9H-Xanthene-3-carboxylic acid, 7-ethoxy-9-oxo-, methyl ester
CAS Number:
89216-75-1
Molecular Formula:
C17H14O5
Molecular Weight:
298.2901
IUPAC Name:
methyl 7-ethoxy-9-oxoxanthene-3-carboxylate
InChI:
InChI=1S/C17H14O5/c1-3-21-11-5-7-14-13(9-11)16(18)12-6-4-10(17(19)20-2)8-15(12)22-14/h4-9H,3H2,1-2H3
InChI Key:
YKKGRXTXHBFURJ-UHFFFAOYSA-N
SMILES:
CCOc1ccc2c(c1)c(=O)c1c(o2)cc(cc1)C(=O)OC
Properties
Complexity:
435
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.084g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.294g/mol
Monoisotopic Mass:
298.084g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.