3-(2-methoxyphenoxy)-6-nitro-1??,2-benzothiazole-1,1-dione

3-(2-methoxyphenoxy)-6-nitro-1??,2-benzothiazole-1,1-dione

Formula: C14H10N2O6S

SMILES: COC1=CC=CC=C1OC1=NS(=O)(=O)C2=C1C=CC(=C2)[N+]([O-])=O

IUPAC: 3-(2-methoxyphenoxy)-6-nitro-1??,2-benzothiazole-1,1-dione

InChI: InChI=1S/C14H10N2O6S/c1-21-11-4-2-3-5-12(11)22-14-10-7-6-9(16(17)18)8-13(10)23(19,20)15-14/h2-8H,1H3

Composition: C (50.30%), H (3.02%), N (8.38%), O (28.71%), S (9.59%)

Molar Mass: 334.3

Atom Count: 33

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	334.025957224
Formal Charge	0
FSP3	0.07
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	0
InChIKey	NOYAEGUGWRTKSL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	79.76
Topological Polar Surface Area	108.1
Polarizability	31.07
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C14H10N2O6S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00