Cas no 51163-27-0 (4-isocyanato-1,2-dimethylbenzene)
4-isocyanato-1,2-dimethylbenzene is a versatile organic compound with a unique structure. It boasts high thermal stability and excellent compatibility with various polymers, making it ideal for applications in the synthesis of polyurethane materials. Its isocyanato functionality facilitates cross-linking, enhancing the mechanical properties of the resulting products. This compound is also known for its low volatility, which contributes to improved process control and safety during manufacturing.
51163-27-0 structure
Product Name:4-isocyanato-1,2-dimethylbenzene
CAS No:51163-27-0
MF:C9H9NO
MW:147.173862218857
MDL:MFCD00013867
CID:89625
PubChem ID:4389663
Update Time:2025-06-20
4-isocyanato-1,2-dimethylbenzene Chemical and Physical Properties
Names and Identifiers
-
- 3,4-dimethylphenyl isocyanate
- 4-Isocyanato-1,2-dimethylbenzene
- SY078927
- 51163-27-0
- E78163
- F1945-0009
- Benzene, 4-isocyanato-1,2-dimethyl-
- 3,4-Dimethylphenyl isocyanate, 98%
- Q27127076
- 3,4-dimethylphenylisocyanate
- EN300-146891
- SCHEMBL58809
- VS-14427
- A828470
- W-200401
- 4-isocyanato-1,2-dimethyl-benzene
- 3,4-dimethyl phenylisocyanate
- CHEBI:60098
- 3,4-dimethyl phenyl isocyanate
- AYCDBMRVKSXYKW-UHFFFAOYSA-N
- GEO-02567
- AKOS000183991
- 1-isocyanato-3,4-dimethyl-benzene
- BB 0254650
- 4-isocyanato-1,2-dimethyl benzene
- FT-0614382
- MFCD00013867
- DTXSID50402752
- STK504576
- ALBB-007506
- BBL037753
- DB-051911
- DTXCID80353607
- 4-isocyanato-1,2-dimethylbenzene
-
- MDL: MFCD00013867
- Inchi: 1S/C9H9NO/c1-7-3-4-9(10-6-11)5-8(7)2/h3-5H,1-2H3
- InChI Key: AYCDBMRVKSXYKW-UHFFFAOYSA-N
- SMILES: O=C=NC1C=CC(C)=C(C)C=1
- BRN: 775149
Computed Properties
- Exact Mass: 147.06800
- Monoisotopic Mass: 147.068
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 172
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: nothing
- Topological Polar Surface Area: 29.4A^2
Experimental Properties
- Color/Form: liquid
- Density: 1.051?g/mL?at 25?°C(lit.)
- Boiling Point: 85?°C2?mm Hg(lit.)
- Flash Point: 198?°F
- Refractive Index: n20/D 1.536(lit.)
- Water Partition Coefficient: Hydrolyzes in water.
- PSA: 29.43000
- LogP: 2.27070
- Solubility: Hydrolyzable
- Sensitiveness: Moisture Sensitive
4-isocyanato-1,2-dimethylbenzene Security Information
- Hazardous Material transportation number:UN 2206 6.1/PG 2
- WGK Germany:3
- Hazard Category Code: 20/21/22-36/37/38
- Safety Instruction: S23-S26-S36/37/39-S45
-
Hazardous Material Identification:
- Packing Group:III
- Hazard Level:6.1
- HazardClass:6.1
- PackingGroup:III
- Safety Term:6.1
- Packing Group:III
- Risk Phrases:R23/25; R36/37/38; R42
4-isocyanato-1,2-dimethylbenzene Customs Data
- HS CODE:2929109000
- Customs Data:
China Customs Code:
2929109000Overview:
2929109000. Other isocyanates. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%
Declaration elements:
Product Name, component content, use to
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 Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | D461928-10mg |
3,4-Dimethylphenyl Isocyanate |
51163-27-0 | 10mg |
$ 50.00 | 2022-06-05 | ||
| TRC | D461928-50mg |
3,4-Dimethylphenyl Isocyanate |
51163-27-0 | 50mg |
$ 65.00 | 2022-06-05 | ||
| TRC | D461928-100mg |
3,4-Dimethylphenyl Isocyanate |
51163-27-0 | 100mg |
$ 80.00 | 2022-06-05 | ||
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | D914675-1g |
3,4-Dimethylphenyl isocyanate |
51163-27-0 | 97% | 1g |
¥234.00 | 2022-01-10 | |
| A FA AI SHA , SAI MO FEI SHI ER KE JI QI XIA GONG SI | L15998-1g |
3,4-Dimethylphenyl isocyanate, 97% |
51163-27-0 | 97% | 1g |
¥477.00 | 2023-03-01 | |
| A FA AI SHA , SAI MO FEI SHI ER KE JI QI XIA GONG SI | L15998-5g |
3,4-Dimethylphenyl isocyanate, 97% |
51163-27-0 | 97% | 5g |
¥1608.00 | 2023-03-01 | |
| A FA AI SHA , SAI MO FEI SHI ER KE JI QI XIA GONG SI | L15998-25g |
3,4-Dimethylphenyl isocyanate, 97% |
51163-27-0 | 97% | 25g |
¥5720.00 | 2023-03-01 | |
| Apollo Scientific | OR936712-1g |
3,4-Dimethylphenyl isocyanate |
51163-27-0 | 98+% | 1g |
£15.00 | 2025-03-21 | |
| Apollo Scientific | OR936712-5g |
3,4-Dimethylphenyl isocyanate |
51163-27-0 | 98+% | 5g |
£27.00 | 2025-03-21 | |
| Apollo Scientific | OR936712-25g |
3,4-Dimethylphenyl isocyanate |
51163-27-0 | 98+% | 25g |
£76.00 | 2025-02-20 |
4-isocyanato-1,2-dimethylbenzene Related Literature
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
-
Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
-
Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
-
Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
-
Eunice Y.-L. Hui,Bhimsen Rout,Yaw Sing Tan,Kok-Ping Chan,Charles W. Johannes Org. Biomol. Chem., 2018,16, 389-392
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