200,000+ products from a single source!
sales@angenechem.com
29451-76-1 | 1-Dibenzothiophenamine
CAS No: 29451-76-1 Catalog No: AG002YF8 MDL No:
Product Description
Catalog Number:
AG002YF8
Chemical Name:
1-Dibenzothiophenamine
CAS Number:
29451-76-1
Molecular Formula:
C12H9NS
Molecular Weight:
199.2716
IUPAC Name:
dibenzothiophen-1-amine
InChI:
InChI=1S/C12H9NS/c13-9-5-3-7-11-12(9)8-4-1-2-6-10(8)14-11/h1-7H,13H2
InChI Key:
LUOGSASRTYIOCL-UHFFFAOYSA-N
SMILES:
Nc1cccc2c1c1ccccc1s2
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.046g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
199.271g/mol
Monoisotopic Mass:
199.046g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
Literature
| Title | Journal |
|---|---|
| Mechanistic study on rearrangement cascades starting from annulated 2-aza-hepta-2,4-dienyl-6-ynyl anions: formation of aniline and azepine derivatives. | Chemistry (Weinheim an der Bergstrasse, Germany) 20070101 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.