CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Alpha-bromo-alpha-ethylbutyrylurea is an odorless tasteless white crystalline powder. Saturated solution in water neutral to litmus. (NTP, 1992) |
|---|---|
| Color/Form | WHITE, CRYSTALLINE POWDER |
| Odor | ODORLESS |
| Taste | TASTELESS |
| Melting Point | 244 °F (NTP, 1992) |
| Solubility | less than 1 mg/mL at 72 °F (NTP, 1992) |
| Density | 1.544 at 77 °F (NTP, 1992) - Denser than water; will sink |
| Collision Cross Section | 139.8 Ų [M+H]+ [CCS Type: TW, Method: Major Mix IMS/Tof Calibration Kit (Waters)] |
| Kovats Retention Index | 1509 1513 1515 1515 1515 1525 1500 1500 1513 1560 1513 1501 1501 |
| Other Experimental Properties | DISSOLVES IN CONCN SULFURIC, NITRIC & HYDROCHLORIC ACIDS FROM WHICH IT IS PPT ON DILUTION WITH WATER |
COMPUTED DESCRIPTORS
| Molecular Weight | 237.09 g/mol |
|---|---|
| XLogP3 | 1.5 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 236.01604 g/mol |
| Monoisotopic Mass | 236.01604 g/mol |
| Topological Polar Surface Area | 72.2 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 190 |
| 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
Alpha-bromo-alpha-ethylbutyrylurea is an odorless tasteless white crystalline powder. Saturated solution in water neutral to litmus. (NTP, 1992)