102-08-9
Product Name:
1,3-Diphenyl-2-thiourea
Formula:
C13H12N2S
Synonyms:
1,3-Diphenyl-2-thiourea;Diphenylsulfourea;N,N′-Diphenylthiourea;Thiocarbanilide;Thiocarbanilide, 1,3-Diphenylthiourea
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Thiocarbanilide is a white to off-white powder. (NTP, 1992) |
|---|---|
| Color/Form | CRYSTALLINE LEAFLETS |
| Boiling Point | Decomposes (NTP, 1992) |
| Melting Point | 309 °F (NTP, 1992) |
| Solubility | less than 0.1 mg/mL at 66 °F (NTP, 1992) |
| Density | 1.32 (NTP, 1992) - Denser than water; will sink |
| Vapor Pressure | 0.00000594 [mmHg] |
| Decomposition | WHEN HEATED TO DECOMP, IT EMITS HIGHLY TOXIC FUMES OF SO(X). |
| Chemical Classes | Nitrogen Compounds -> Thiourea Compounds |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07  Health Hazard GHS08  Environment GHS09 |
| GHS Hazard Statements |
H317:Sensitisation, Skin H373:Specific target organ toxicity, repeated exposure H411:Hazardous to the aquatic environment, long-term hazard |
| Precautionary Statement Codes |
P201:Obtain special instructions before use. P202:Do not handle until all safety precautions have been read and understood. P273:Avoid release to the environment. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of soap and water. P308+P313:IF exposed or concerned: Get medical advice/attention. |
COMPUTED DESCRIPTORS
| Molecular Weight | 228.31 g/mol |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 2 |
| Exact Mass | 228.07211956 g/mol |
| Monoisotopic Mass | 228.07211956 g/mol |
| Topological Polar Surface Area | 56.2 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
Thiocarbanilide is a white to off-white powder. (NTP, 1992)