200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 190841-72-6
190841-72-6 | [9,9'-Biphenanthrene]-10,10'-dithiol
CAS No: 190841-72-6 Catalog No: AG002EVA MDL No:
Product Description
Catalog Number:
AG002EVA
Chemical Name:
[9,9'-Biphenanthrene]-10,10'-dithiol
CAS Number:
190841-72-6
Molecular Formula:
C28H18S2
Molecular Weight:
418.5725
IUPAC Name:
10-(10-sulfanylphenanthren-9-yl)phenanthrene-9-thiol
InChI:
InChI=1S/C28H18S2/c29-27-23-15-7-3-11-19(23)17-9-1-5-13-21(17)25(27)26-22-14-6-2-10-18(22)20-12-4-8-16-24(20)28(26)30/h1-16,29-30H
InChI Key:
UNNLMSFBYKRFHD-UHFFFAOYSA-N
SMILES:
Sc1c(c2ccccc2c2c1cccc2)c1c(S)c2ccccc2c2c1cccc2
Properties
Complexity:
551
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
418.085g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
418.572g/mol
Monoisotopic Mass:
418.085g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.