Carbamothioic acid,N-phenyl-, O-ethyl ester
Carbamothioic acid,N-phenyl-, O-ethyl ester structure
|
Common Name | Carbamothioic acid,N-phenyl-, O-ethyl ester | ||
|---|---|---|---|---|
| CAS Number | 3111-89-5 | Molecular Weight | 181.25500 | |
| Density | 1.182g/cm3 | Boiling Point | 246.1ºC at 760mmHg | |
| Molecular Formula | C9H11NOS | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 102.6ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | O-ethyl N-phenylcarbamothioate |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.182g/cm3 |
|---|---|
| Boiling Point | 246.1ºC at 760mmHg |
| Molecular Formula | C9H11NOS |
| Molecular Weight | 181.25500 |
| Flash Point | 102.6ºC |
| Exact Mass | 181.05600 |
| PSA | 53.35000 |
| LogP | 2.49290 |
| Index of Refraction | 1.624 |
| InChIKey | WXNKKAIEQXMTBZ-UHFFFAOYSA-N |
| SMILES | CCOC(=S)Nc1ccccc1 |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2930909090 |
|---|
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 9 | |
|---|---|
| DownStream 10 | |
CAS#:64-17-5
CAS#:103-72-0
CAS#:140-89-6
CAS#:2762-59-6
CAS#:7442-11-7
CAS#:15093-54-6
CAS#:854-42-2![ethyl cyano[[dimethylamino(phenylimino)methyl]thio]acetate Structure](https://image.chemsrc.com/caspic/172/81852-22-4.png)
CAS#:81852-22-4
CAS#:122-51-0
CAS#:101-99-5
CAS#:603-54-3
CAS#:3898-08-6
CAS#:102-08-9
CAS#:1215-77-6
CAS#:1010-53-3
CAS#:70292-64-7
CAS#:880-84-2This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2930909090 |
|---|---|
| Summary | 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
|
Name: NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
Source: DTP/NCI
Target: N/A
External Id: MCF7_OneDose
|
|
Name: NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell...
Source: DTP/NCI
Target: N/A
External Id: IGROV1_OneDose
|
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| Ethyl N-phenylthiocarbamate |
| Ethyl phenylaminothioformate |
| phenyl-thiocarbamic acid O-ethyl ester |
| O-Ethyl phenylthiocarbamate |
| Phenylthiourethane |
| Carbanilic acid,thiono-,ethyl ester |
| O-Ethyl thiocarbanilate |
| Phenyl-thiocarbamidsaeure-O-aethylester |
| O-Ethyl phenylcarbamothioate |
| O-ethyl N-phenylthiocarbamate |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the polar surface area (PSA) of O-ethyl N-phenylcarbamothioate? |
| A: Polar surface area (PSA) of O-ethyl N-phenylcarbamothioate is 53.35000. |
| Q: What is the molecular weight of O-ethyl N-phenylcarbamothioate? |
| A: Molecular weight of O-ethyl N-phenylcarbamothioate is 181.25500. |
| Q: What is the molecular formula of O-ethyl N-phenylcarbamothioate? |
| A: Molecular formula of O-ethyl N-phenylcarbamothioate is C9H11NOS. |
| Q: What is the SMILES notation of O-ethyl N-phenylcarbamothioate? |
| A: SMILES notation of O-ethyl N-phenylcarbamothioate is CCOC(=S)Nc1ccccc1. |
| Q: What is the InChIKey of O-ethyl N-phenylcarbamothioate? |
| A: InChIKey of O-ethyl N-phenylcarbamothioate is WXNKKAIEQXMTBZ-UHFFFAOYSA-N. |
| Q: What are the downstream products of O-ethyl N-phenylcarbamothioate? |
| A: Related downstream products(CAS) of O-ethyl N-phenylcarbamothioate: 101-99-5;64-17-5;603-54-3;3898-08-6;103-72-0;102-08-9;1215-77-6;1010-53-3;70292-64-7;880-84-2. |
| Q: What is the English name of O-ethyl N-phenylcarbamothioate? |
| A: The English name of O-ethyl N-phenylcarbamothioate is O-ethyl N-phenylcarbamothioate. |
| Q: What are the upstream materials of O-ethyl N-phenylcarbamothioate? |
| A: Related upstream materials(CAS) of O-ethyl N-phenylcarbamothioate: 64-17-5;103-72-0;140-89-6;2762-59-6;7442-11-7;15093-54-6;854-42-2;81852-22-4;122-51-0. |
| Q: What is the Chinese name of 3111-89-5? |
| A: Chinese name of 3111-89-5 is 3111-89-5. |
| Q: What is the LogP of O-ethyl N-phenylcarbamothioate? |
| A: LogP of O-ethyl N-phenylcarbamothioate is 2.49290. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Dayang Chem (Hangzhou) Co., Ltd. |