Cas no 41513-02-4 (1-bromo-4-isocyanato-2-(trifluoromethyl)benzene)
41513-02-4 structure
Product Name:1-bromo-4-isocyanato-2-(trifluoromethyl)benzene
CAS No:41513-02-4
MF:C8H3BrF3NO
MW:266.014731645584
MDL:MFCD20429994
CID:328732
PubChem ID:23137217
Update Time:2025-04-19
1-bromo-4-isocyanato-2-(trifluoromethyl)benzene Chemical and Physical Properties
Names and Identifiers
-
- 4-BROMO-2-(TRIFLUOROMETHYL)PHENYL ISOCYANATE
- 484946_ALDRICH
- 4-bromo-3-(trifluoromethyl)phenyl isocyanate
- AC1MQOOC
- AC1Q4ILZ
- AG-F-47675
- CTK4I4941
- GEO-02901
- 1-bromo-4-isocyanato-2-(trifluoromethyl)benzene
- AKOS009159386
- DTXSID30392869
- A813062
- J-011985
- SCHEMBL1149137
- 4-bromo-1-isocyanato-2-(trifluoromethyl)benzene
- 41513-02-4
- MFCD00013871
- 186589-12-8
- 4-Bromo-2-(trifluoromethyl)phenyl isocyanate, 96%
- 4-4-Bromo-2-(trifluoromethyl)phenyl isocyanate
-
- MDL: MFCD20429994
- Inchi: 1S/C8H3BrF3NO/c9-5-1-2-7(13-4-14)6(3-5)8(10,11)12/h1-3H
- InChI Key: UZFHKVBCBXPKKE-UHFFFAOYSA-N
- SMILES: BrC1C=CC(=C(C(F)(F)F)C=1)N=C=O
Computed Properties
- Exact Mass: 264.93499
- Monoisotopic Mass: 264.935
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 250
- 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
- XLogP3: 4.3
- Topological Polar Surface Area: 29.4?2
Experimental Properties
- Density: 1.699?g/mL?at 25?°C(lit.)
- Boiling Point: 115?°C10?mm Hg(lit.)
- Flash Point: 230?°F
- Refractive Index: n20/D 1.524(lit.)
- PSA: 29.43
- LogP: 3.43520
1-bromo-4-isocyanato-2-(trifluoromethyl)benzene Security Information
- Hazardous Material transportation number:UN 2206 6.1/PG 3
- WGK Germany:3
- Hazard Category Code: 20/21/22-36/37/38
- Safety Instruction: 26-36
-
Hazardous Material Identification:
- Risk Phrases:20/21/22-36/37/38
1-bromo-4-isocyanato-2-(trifluoromethyl)benzene Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Enamine | EN300-277187-1g |
1-bromo-4-isocyanato-2-(trifluoromethyl)benzene |
41513-02-4 | 1g |
$557.0 | 2023-09-10 | ||
| Enamine | EN300-277187-5g |
1-bromo-4-isocyanato-2-(trifluoromethyl)benzene |
41513-02-4 | 5g |
$1614.0 | 2023-09-10 | ||
| Enamine | EN300-277187-10g |
1-bromo-4-isocyanato-2-(trifluoromethyl)benzene |
41513-02-4 | 10g |
$2393.0 | 2023-09-10 | ||
| Matrix Scientific | 190640-5g |
1-Bromo-4-isocyanato-2-(trifluoromethyl)benzene, 95% |
41513-02-4 | 95% | 5g |
$1650.00 | 2023-09-11 | |
| Enamine | EN300-277187-0.05g |
1-bromo-4-isocyanato-2-(trifluoromethyl)benzene |
41513-02-4 | 95.0% | 0.05g |
$468.0 | 2025-03-20 | |
| Enamine | EN300-277187-0.1g |
1-bromo-4-isocyanato-2-(trifluoromethyl)benzene |
41513-02-4 | 95.0% | 0.1g |
$490.0 | 2025-03-20 | |
| Enamine | EN300-277187-0.25g |
1-bromo-4-isocyanato-2-(trifluoromethyl)benzene |
41513-02-4 | 95.0% | 0.25g |
$513.0 | 2025-03-20 | |
| Enamine | EN300-277187-0.5g |
1-bromo-4-isocyanato-2-(trifluoromethyl)benzene |
41513-02-4 | 95.0% | 0.5g |
$535.0 | 2025-03-20 | |
| Enamine | EN300-277187-1.0g |
1-bromo-4-isocyanato-2-(trifluoromethyl)benzene |
41513-02-4 | 95.0% | 1.0g |
$557.0 | 2025-03-20 | |
| Enamine | EN300-277187-2.5g |
1-bromo-4-isocyanato-2-(trifluoromethyl)benzene |
41513-02-4 | 95.0% | 2.5g |
$1089.0 | 2025-03-20 |
1-bromo-4-isocyanato-2-(trifluoromethyl)benzene Related Literature
-
Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
-
Xingqun Zheng,Lele Song,Xin Feng,Li Li,Zidong Wei J. Mater. Chem. A, 2020,8, 14145-14151
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
-
Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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