200,000+ products from a single source!
sales@angenechem.com
88605-40-7 | 9,10-Anthracenedione, 1,4-diamino-6-chloro-2-(2-phenylethoxy)-
CAS No: 88605-40-7 Catalog No: AG004AV7 MDL No:
Product Description
Catalog Number:
AG004AV7
Chemical Name:
9,10-Anthracenedione, 1,4-diamino-6-chloro-2-(2-phenylethoxy)-
CAS Number:
88605-40-7
Molecular Formula:
C22H17ClN2O3
Molecular Weight:
392.8350
IUPAC Name:
1,4-diamino-6-chloro-2-(2-phenylethoxy)anthracene-9,10-dione
InChI:
InChI=1S/C22H17ClN2O3/c23-13-6-7-14-15(10-13)22(27)18-16(24)11-17(20(25)19(18)21(14)26)28-9-8-12-4-2-1-3-5-12/h1-7,10-11H,8-9,24-25H2
InChI Key:
XJJDAQFNWHPBJG-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)C(=O)c1c(C2=O)c(N)c(cc1N)OCCc1ccccc1
Properties
Complexity:
594
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
392.093g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
392.839g/mol
Monoisotopic Mass:
392.093g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
95.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.