200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 1000575-87-0
1000575-87-0 | 4-Methyl-3-methylthio-7-nitro-4H-1,2,4-benzothiadiazin-1,1-dioxide
CAS No: 1000575-87-0 Catalog No: AG01F5GN MDL No:
Product Description
Catalog Number:
AG01F5GN
Chemical Name:
4-Methyl-3-methylthio-7-nitro-4H-1,2,4-benzothiadiazin-1,1-dioxide
CAS Number:
1000575-87-0
Molecular Formula:
C9H9N3O4S2
Molecular Weight:
287.3155
IUPAC Name:
4-methyl-3-methylsulfanyl-7-nitro-1λ6,2,4-benzothiadiazine 1,1-dioxide
InChI:
InChI=1S/C9H9N3O4S2/c1-11-7-4-3-6(12(13)14)5-8(7)18(15,16)10-9(11)17-2/h3-5H,1-2H3
InChI Key:
WVCWKASXEFWTPX-UHFFFAOYSA-N
SMILES:
CSC1=NS(=O)(=O)c2c(N1C)ccc(c2)[N+](=O)[O-]
Properties
Complexity:
479
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.003g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
287.308g/mol
Monoisotopic Mass:
287.003g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
129A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.