200,000+ products from a single source!
sales@angenechem.com
Home > Aldehydes > 727652-17-7
727652-17-7 | 2-(3-Nitro-phenyl)-benzo[d]imidazo[2,1-b]thiazole-3-carbaldehyde
CAS No: 727652-17-7 Catalog No: AG01EX5C MDL No:
Product Description
Catalog Number:
AG01EX5C
Chemical Name:
2-(3-Nitro-phenyl)-benzo[d]imidazo[2,1-b]thiazole-3-carbaldehyde
CAS Number:
727652-17-7
Molecular Formula:
C16H9N3O3S
Molecular Weight:
323.3260
IUPAC Name:
2-(3-nitrophenyl)imidazo[2,1-b][1,3]benzothiazole-1-carbaldehyde
InChI:
InChI=1S/C16H9N3O3S/c20-9-13-15(10-4-3-5-11(8-10)19(21)22)17-16-18(13)12-6-1-2-7-14(12)23-16/h1-9H
InChI Key:
WGFTXAXKEFFDJA-UHFFFAOYSA-N
SMILES:
O=Cc1c(nc2n1c1ccccc1s2)c1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
486
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.036g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
323.326g/mol
Monoisotopic Mass:
323.036g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.