200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 89227-27-0
89227-27-0 | 1,4-Naphthalenedione, 5-(dodecylsulfinyl)-2,3-dimethoxy-
CAS No: 89227-27-0 Catalog No: AG0042ZA MDL No:
Product Description
Catalog Number:
AG0042ZA
Chemical Name:
1,4-Naphthalenedione, 5-(dodecylsulfinyl)-2,3-dimethoxy-
CAS Number:
89227-27-0
Molecular Formula:
C24H34O5S
Molecular Weight:
434.5888
IUPAC Name:
5-dodecylsulfinyl-2,3-dimethoxynaphthalene-1,4-dione
InChI:
InChI=1S/C24H34O5S/c1-4-5-6-7-8-9-10-11-12-13-17-30(27)19-16-14-15-18-20(19)22(26)24(29-3)23(28-2)21(18)25/h14-16H,4-13,17H2,1-3H3
InChI Key:
YYANQGDVWVMITC-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCS(=O)c1cccc2c1C(=O)C(=C(C2=O)OC)OC
Properties
Complexity:
627
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
434.213g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
434.591g/mol
Monoisotopic Mass:
434.213g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
88.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
6.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.