12768-92-2 | C.I. Fluorescent Brightener 113

Packsize	Purity	Availability	Price	Discounted Price
1g		in stock	$237.00	$166.00

Description

• Catalog Number: AA42945
• Chemical Name: C.I. Fluorescent Brightener 113
• CAS Number: 12768-92-2
• Molecular Formula: C40H42N12Na2O10S2
• Molecular Weight: 960.9454
• MDL Number: MFCD14636465
• SMILES: CCON(C1=NC(=NC(=N1)NC2=CC(=C(C=C2)C=CC3=C(C=C(C=C3)NC4=NC(=NC(=N4)NC5=CC=CC=C5)N(OCC)OCC)S(=O)(=O)[O-])S(=O)(=O)[O-])NC6=CC=CC=C6)OCC.[Na+].[Na+]

Computed Properties

• Complexity: 1470
• Covalently-Bonded Unit Count: 3
• Defined Bond Stereocenter Count: 1
• Heavy Atom Count: 66
• Hydrogen Bond Acceptor Count: 22
• Hydrogen Bond Donor Count: 4
• Rotatable Bond Count: 20