200,000+ products from a single source!
sales@angenechem.com
Home > Fluorides > 880704-01-8
880704-01-8 | 6,13-Pentacenediol, 6,13-bis(9,9-diethyl-9H-fluoren-2-yl)-6,13-dihydro-
CAS No: 880704-01-8 Catalog No: AG004KNU MDL No:
Product Description
Catalog Number:
AG004KNU
Chemical Name:
6,13-Pentacenediol, 6,13-bis(9,9-diethyl-9H-fluoren-2-yl)-6,13-dihydro-
CAS Number:
880704-01-8
Molecular Formula:
C56H48O2
Molecular Weight:
752.9791
IUPAC Name:
6,13-bis(9,9-diethylfluoren-2-yl)pentacene-6,13-diol
InChI:
InChI=1S/C56H48O2/c1-5-53(6-2)45-23-15-13-21-41(45)43-27-25-39(33-47(43)53)55(57)49-29-35-17-9-11-19-37(35)31-51(49)56(58,52-32-38-20-12-10-18-36(38)30-50(52)55)40-26-28-44-42-22-14-16-24-46(42)54(7-3,8-4)48(44)34-40/h9-34,57-58H,5-8H2,1-4H3
InChI Key:
IVCWHOVVWKHYNA-UHFFFAOYSA-N
SMILES:
CCC1(CC)c2cc(ccc2c2c1cccc2)C1(O)c2cc3ccccc3cc2C(c2c1cc1ccccc1c2)(O)c1ccc2c(c1)C(CC)(CC)c1c2cccc1
Properties
Complexity:
1310
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
752.365g/mol
Formal Charge:
0
Heavy Atom Count:
58
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
752.998g/mol
Monoisotopic Mass:
752.365g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
14.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.