200,000+ products from a single source!
sales@angenechem.com
130994-77-3 | 3H-Xanthen-3-one, 9-(4-chlorophenyl)-2,6,7-trihydroxy-
CAS No: 130994-77-3 Catalog No: AG000V8I MDL No:
Product Description
Catalog Number:
AG000V8I
Chemical Name:
3H-Xanthen-3-one, 9-(4-chlorophenyl)-2,6,7-trihydroxy-
CAS Number:
130994-77-3
Molecular Formula:
C19H11ClO5
Molecular Weight:
354.7406
IUPAC Name:
9-(4-chlorophenyl)-2,6,7-trihydroxyxanthen-3-one
InChI:
InChI=1S/C19H11ClO5/c20-10-3-1-9(2-4-10)19-11-5-13(21)15(23)7-17(11)25-18-8-16(24)14(22)6-12(18)19/h1-8,21-23H
InChI Key:
NOCRJDBUABRERO-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)c1c2cc(O)c(=O)cc2oc2c1cc(O)c(c2)O
Properties
Complexity:
671
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
354.03g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
354.742g/mol
Monoisotopic Mass:
354.03g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
87A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.