Cas no 306935-08-0 (([AMINO(IMINO)METHYL]AMINO)[3,5-DI(TRIFLUOROMETHYL)PHENYL]DIOXO-LAMBDA6-SULFANE HYDRATE)
![([AMINO(IMINO)METHYL]AMINO)[3,5-DI(TRIFLUOROMETHYL)PHENYL]DIOXO-LAMBDA6-SULFANE HYDRATE structure](https://ossimg.kuujia.com/scimg/307000/306935-08-0x500.png)
306935-08-0 structure
Product Name:([AMINO(IMINO)METHYL]AMINO)[3,5-DI(TRIFLUOROMETHYL)PHENYL]DIOXO-LAMBDA6-SULFANE HYDRATE
CAS No:306935-08-0
MF:C9H9F6N3O3S
MW:353.241481542587
CID:300078
PubChem ID:2780085
Update Time:2025-04-19
([AMINO(IMINO)METHYL]AMINO)[3,5-DI(TRIFLUOROMETHYL)PHENYL]DIOXO-LAMBDA6-SULFANE HYDRATE Chemical and Physical Properties
Names and Identifiers
-
- ([AMINO(IMINO)METHYL]AMINO)[3,5-DI(TRIFLUOROMETHYL)PHENYL]DIOXO-LAMBDA6-SULFANE HYDRATE
- {[AMINO(IMINO)METHYL]AMINO}[3,5-DI(TRIFLUOROMETHYL)PHENYL]DIOXO-LAMBDA~6~-SULFANE HYDRATE
- N-(diaminomethylidene)-3,5-bis(trifluoromethyl)benzenesulfonamide hydrate
- HMS549P21
- {[amino(imino)methyl]amino}[3,5-di(trifluoromethyl)phenyl]dioxo-lambda~6~-sulphane hydrate
- 306935-08-0
- FT-0605450
- 2-[3,5-bis(trifluoromethyl)phenyl]sulfonylguanidine;hydrate
-
- Inchi： 1S/C9H7F6N3O2S.H2O/c10-8(11,12)4-1-5(9(13,14)15)3-6(2-4)21(19,20)18-7(16)17;/h1-3H,(H4,16,17,18);1H2
- InChI Key： SDLNWIFQHKQCMG-UHFFFAOYSA-N
- SMILES： S(C1C=C(C(F)(F)F)C=C(C(F)(F)F)C=1)(/N=C(\N)/N)(=O)=O.O
Computed Properties
- Exact Mass: 353.02700
- Monoisotopic Mass: 353.02688130g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 10
- Heavy Atom Count: 22
- Rotatable Bond Count: 2
- Complexity: 481
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 108?2
Experimental Properties
- Boiling Point: 379.8°C at 760 mmHg
- Flash Point: 183.5°C
- PSA: 113.65000
- LogP: 4.10340
([AMINO(IMINO)METHYL]AMINO)[3,5-DI(TRIFLUOROMETHYL)PHENYL]DIOXO-LAMBDA6-SULFANE HYDRATE Related Literature
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Hailing Chen,Lu Yin,Meng Liu,Laibing Wang,Michiya Fujiki,Wei Zhang RSC Adv., 2019,9, 4849-4856
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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