CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | C.i. vat brown 3 is an odorless brown to dark brown powder. (NTP, 1992) |
|---|---|
| Melting Point | 356 °F (decomposes) (NTP, 1992) |
| Solubility | less than 1 mg/mL at 66 °F (NTP, 1992) |
COMPUTED DESCRIPTORS
| Molecular Weight | 665.6 g/mol |
|---|---|
| XLogP3 | 8.1 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 4 |
| Exact Mass | 665.15868546 g/mol |
| Monoisotopic Mass | 665.15868546 g/mol |
| Topological Polar Surface Area | 142 Ų |
| Heavy Atom Count | 51 |
| Formal Charge | 0 |
| Complexity | 1450 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
C.i. vat brown 3 is an odorless brown to dark brown powder. (NTP, 1992)