102-07-8
Product Name:
1,3-Diphenylurea
Formula:
C13H12N2O
Synonyms:
N,N′-Diphenylurea;Carbanilide
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | 1,3-diphenylurea is an off-white powder. (NTP, 1992) |
|---|---|
| Color/Form | RHOMBIC BIPYRAMIDAL PRISMS FROM ALCOHOL |
| Boiling Point | 504 °F at 760 mmHg (Decomposes) (NTP, 1992) |
| Melting Point | 460 °F (NTP, 1992) |
| Solubility | less than 0.1 mg/mL at 64 °F (NTP, 1992) |
| Density | 1.239 (NTP, 1992) - Denser than water; will sink |
| LogP | 3.00 |
| Kovats Retention Index | 2203.6 |
| Other Experimental Properties | SUBLIMES IN CURRENT OF HYDROGEN AT 220 °C |
| Chemical Classes | Nitrogen Compounds -> Urea Compounds |
COMPUTED DESCRIPTORS
| Molecular Weight | 212.25 g/mol |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 2 |
| Exact Mass | 212.094963011 g/mol |
| Monoisotopic Mass | 212.094963011 g/mol |
| Topological Polar Surface Area | 41.1 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 196 |
| 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
1,3-diphenylurea is an off-white powder. (NTP, 1992)