3,4-dimethylphenyl isocyanate
Modify Date: 2025-08-25 19:39:54
3,4-dimethylphenyl isocyanate structure
|
Common Name | 3,4-dimethylphenyl isocyanate | ||
|---|---|---|---|---|
| CAS Number | 51163-27-0 | Molecular Weight | 147.17400 | |
| Density | 1.051 | Boiling Point | 85ºC2 mm Hg(lit.) | |
| Molecular Formula | C9H9NO | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 198 °F | |
| Name | 3,4-dimethylphenyl isocyanate |
|---|---|
| Synonym | More Synonyms |
| Density | 1.051 |
|---|---|
| Boiling Point | 85ºC2 mm Hg(lit.) |
| Molecular Formula | C9H9NO |
| Molecular Weight | 147.17400 |
| Flash Point | 198 °F |
| Exact Mass | 147.06800 |
| PSA | 29.43000 |
| LogP | 2.27070 |
| Index of Refraction | n20/D 1.536(lit.) |
| InChIKey | AYCDBMRVKSXYKW-UHFFFAOYSA-N |
| SMILES | Cc1ccc(N=C=O)cc1C |
| Storage condition | 2-8°C |
| Hazard Codes | Xn |
|---|---|
| Risk Phrases | R23/25;R36/37/38;R42 |
| Safety Phrases | S23-S26-S36/37/39-S45 |
| RIDADR | UN 2206 6.1/PG 2 |
| Packaging Group | III |
| Hazard Class | 6.1 |
| HS Code | 2929109000 |
|
~69%
3,4-dimethylphe... CAS#:51163-27-0 |
| Literature: Yu; Holloway; Flippen-Anderson; Hoffman; Brossi; Greig Journal of Medicinal Chemistry, 2001 , vol. 44, # 24 p. 4062 - 4071 |
|
~%
3,4-dimethylphe... CAS#:51163-27-0 |
| Literature: Bakshi, Pancham; Jin, Chao; Broutin, Pierre; Berhane, Beniam; Reed, Jon; Mullan, Michael Bioorganic and Medicinal Chemistry, 2009 , vol. 17, # 23 p. 8102 - 8112 |
|
~%
3,4-dimethylphe... CAS#:51163-27-0 |
| Literature: Zhao, Yan-Fang; Liu, Zi-Jian; Zhai, Xin; Ge, Dan-Dan; Huang, Qiang; Gong, Ping Chinese Chemical Letters, 2013 , vol. 24, # 5 p. 386 - 388 |
CAS#:86781-22-8
CAS#:88451-13-2| HS Code | 2929109000 |
|---|---|
| Summary | 2929109000. other isocyanates. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
| 4-isocyanato-1,2-dimethylbenzene |
| 3,4-Dimethylphenyl isocyanate |
| MFCD00013867 |