Name: Name:2H-1,4-Benzothiazin-3(4H)-one, 7-nitro-
Brand: Angene
SKU: AG006ZF7
Rating: 90 (10 reviews)

2H-1,4-Benzothiazin-3(4H)-one, 7-nitro-

CAS No.:

21762-75-4

Catalog Number:

AG006ZF7

Molecular Formula:

C8H6N2O3S

Molecular Weight:

210.2098

Catalog Number:

AG006ZF7

Chemical Name:

2H-1,4-Benzothiazin-3(4H)-one, 7-nitro-

CAS Number:

21762-75-4

Molecular Formula:

C8H6N2O3S

Molecular Weight:

210.2098

MDL Number:

MFCD23379853

IUPAC Name:

7-nitro-4H-1,4-benzothiazin-3-one

InChI:

InChI=1S/C8H6N2O3S/c11-8-4-14-7-3-5(10(12)13)1-2-6(7)9-8/h1-3H,4H2,(H,9,11)

InChI Key:

OOICZQBVVODNDJ-UHFFFAOYSA-N

SMILES:

O=C1CSc2c(N1)ccc(c2)[N+](=O)[O-]

NSC Number:

642713

Complexity:

266

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

210.01g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

210.207g/mol

Monoisotopic Mass:

210.01g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

100A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2