Cas no 1004194-69-7 (4-bromo-1-(2-chloro-6-fluorophenyl)methyl-3-isothiocyanato-1H-pyrazole)
1004194-69-7 structure
Product Name:4-bromo-1-(2-chloro-6-fluorophenyl)methyl-3-isothiocyanato-1H-pyrazole
CAS No:1004194-69-7
MF:C11H6BrClFN3S
MW:346.605842113495
MDL:MFCD04968696
CID:3058477
PubChem ID:7017370
Update Time:2025-04-21
4-bromo-1-(2-chloro-6-fluorophenyl)methyl-3-isothiocyanato-1H-pyrazole Chemical and Physical Properties
Names and Identifiers
-
- 4-Bromo-1-(2-chloro-6-fluoro-benzyl)-3-isothiocyanato-1H-pyrazole
- AKOS B017655
- ART-CHEM-BB B017655
- 4-bromo-1-(2-chloro-6-fluorophenyl)methyl-3-isothiocyanato-1H-pyrazole
- C11H6BrClFN3S
- STK349441
- 1004194-69-7
- 4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]-3-isothiocyanatopyrazole
- BBL039857
- AKOS000307029
- EN300-229225
- 4-bromo-1-(2-chloro-6-fluorobenzyl)-3-isothiocyanato-1H-pyrazole
- 4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]-3-isothiocyanato-1h-pyrazole
- 4-bromo-1-[(2-chloro-6-fluoro-phenyl)methyl]-3-isothiocyanato-pyrazole
- CS-0268966
-
- MDL： MFCD04968696
- Inchi： 1S/C11H6BrClFN3S/c12-8-5-17(16-11(8)15-6-18)4-7-9(13)2-1-3-10(7)14/h1-3,5H,4H2
- InChI Key： IFLKITWUKTWYBX-UHFFFAOYSA-N
- SMILES： BrC1C(N=C=S)=NN(C=1)CC1C(=CC=CC=1Cl)F
Computed Properties
- Exact Mass: 344.91384Da
- Monoisotopic Mass: 344.91384Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 3
- Complexity: 342
- 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: 5
- Topological Polar Surface Area: 62.3?2
4-bromo-1-(2-chloro-6-fluorophenyl)methyl-3-isothiocyanato-1H-pyrazole Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Fluorochem | 025932-250mg |
4-Bromo-1-(2-chloro-6-fluoro-benzyl)-3-isothiocyanato-1H-pyrazole |
1004194-69-7 | 250mg |
￡144.00 | 2022-03-01 | ||
| Fluorochem | 025932-5g |
4-Bromo-1-(2-chloro-6-fluoro-benzyl)-3-isothiocyanato-1H-pyrazole |
1004194-69-7 | 5g |
￡782.00 | 2022-03-01 | ||
| Fluorochem | 025932-1g |
4-Bromo-1-(2-chloro-6-fluoro-benzyl)-3-isothiocyanato-1H-pyrazole |
1004194-69-7 | 1g |
￡287.00 | 2022-03-01 | ||
| Enamine | EN300-229225-1g |
4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]-3-isothiocyanato-1H-pyrazole |
1004194-69-7 | 1g |
$728.0 | 2023-09-15 | ||
| Enamine | EN300-229225-5g |
4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]-3-isothiocyanato-1H-pyrazole |
1004194-69-7 | 5g |
$2110.0 | 2023-09-15 | ||
| Enamine | EN300-229225-10g |
4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]-3-isothiocyanato-1H-pyrazole |
1004194-69-7 | 10g |
$3131.0 | 2023-09-15 | ||
| Enamine | EN300-229225-0.05g |
4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]-3-isothiocyanato-1H-pyrazole |
1004194-69-7 | 95% | 0.05g |
$612.0 | 2024-06-20 | |
| Enamine | EN300-229225-0.1g |
4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]-3-isothiocyanato-1H-pyrazole |
1004194-69-7 | 95% | 0.1g |
$640.0 | 2024-06-20 | |
| Enamine | EN300-229225-0.25g |
4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]-3-isothiocyanato-1H-pyrazole |
1004194-69-7 | 95% | 0.25g |
$670.0 | 2024-06-20 | |
| Enamine | EN300-229225-0.5g |
4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]-3-isothiocyanato-1H-pyrazole |
1004194-69-7 | 95% | 0.5g |
$699.0 | 2024-06-20 |
4-bromo-1-(2-chloro-6-fluorophenyl)methyl-3-isothiocyanato-1H-pyrazole Related Literature
-
Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
-
Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
-
Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
-
Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
1004194-69-7 (4-bromo-1-(2-chloro-6-fluorophenyl)methyl-3-isothiocyanato-1H-pyrazole) Related Products
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