Name: Name:2-Benzothiazolamine, 4-methoxy-6-nitro-
Brand: Angene
SKU: AG001WE9
Rating: 90 (10 reviews)

2-Benzothiazolamine, 4-methoxy-6-nitro-

CAS No.:

16586-52-0

Catalog Number:

AG001WE9

Molecular Formula:

C8H7N3O3S

Molecular Weight:

225.2245

Catalog Number:

AG001WE9

Chemical Name:

2-Benzothiazolamine, 4-methoxy-6-nitro-

CAS Number:

16586-52-0

Molecular Formula:

C8H7N3O3S

Molecular Weight:

225.2245

MDL Number:

MFCD00689530

IUPAC Name:

4-methoxy-6-nitro-1,3-benzothiazol-2-amine

InChI:

InChI=1S/C8H7N3O3S/c1-14-5-2-4(11(12)13)3-6-7(5)10-8(9)15-6/h2-3H,1H3,(H2,9,10)

InChI Key:

CPKIXPBVHIJAIR-UHFFFAOYSA-N

SMILES:

COc1cc(cc2c1nc(s2)N)[N+](=O)[O-]

Complexity:

260

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

225.021g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

225.222g/mol

Monoisotopic Mass:

225.021g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

122A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8