94-45-1 | 2-Amino-6-ethoxybenzothiazole

Packsize	Purity	Availability	Price	Discounted Price
250mg	95%	in stock	$13.00	$9.00
1g	95%	in stock	$16.00	$11.00
5g	95%	in stock	$19.00	$13.00
25g	95%	in stock	$34.00	$24.00
100g	95%	in stock	$79.00	$55.00
500g	95%	in stock	$339.00	$237.00

Description

• Catalog Number: AI62821
• Chemical Name: 2-Amino-6-ethoxybenzothiazole
• CAS Number: 94-45-1
• Molecular Formula: C9H10N2OS
• Molecular Weight: 194.2535
• MDL Number: MFCD00005788
• SMILES: CCOc1ccc2c(c1)sc(n2)N
• NSC Number: 28731

Computed Properties

• Complexity: 179
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 13
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 2
• XLogP3: 2.8

Literature

• (E)-2-[(6-Ethoxy-benzothia-zol-2-yl)imino-meth-yl]-6-methoxy-phenol.

  Acta crystallographica. Section E, Structure reports online 20090401

• Prediction of genotoxicity of chemical compounds by statistical learning methods.

  Chemical research in toxicology 20050601