200,000+ products from a single source!
sales@angenechem.com
123364-09-0 | 2H-Pyran-6-carboxylic acid, 3-(3-carboxy-6,7-dihydroxy-1-naphthalenyl)-2-oxo-
CAS No: 123364-09-0 Catalog No: AG000KFL MDL No:
Product Description
Catalog Number:
AG000KFL
Chemical Name:
2H-Pyran-6-carboxylic acid, 3-(3-carboxy-6,7-dihydroxy-1-naphthalenyl)-2-oxo-
CAS Number:
123364-09-0
Molecular Formula:
C17H10O8
Molecular Weight:
342.2565
IUPAC Name:
5-(3-carboxy-6,7-dihydroxynaphthalen-1-yl)-6-oxopyran-2-carboxylic acid
InChI:
InChI=1S/C17H10O8/c18-12-5-7-3-8(15(20)21)4-11(10(7)6-13(12)19)9-1-2-14(16(22)23)25-17(9)24/h1-6,18-19H,(H,20,21)(H,22,23)
InChI Key:
IGGWJZYKGXVCQF-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc2cc(O)c(cc2c(c1)c1ccc(oc1=O)C(=O)O)O
Properties
Complexity:
664
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.038g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
342.259g/mol
Monoisotopic Mass:
342.038g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
141A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.