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Cas Database |
| Name |
Benzenesulfonicacid, 3-(diphenylphosphino)- |
EINECS | N/A |
| CAS No. | 16704-71-5 | Density | N/A |
| PSA | N/A | LogP | N/A |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C18H15O3PS | Boiling Point | N/A |
| Molecular Weight | 342.3487 | Flash Point | N/A |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Benzenesulfonicacid, m-(diphenylphosphino)- (8CI);(m-Sulfophenyl)diphenylphosphine;Diphenyl(3-sulfophenyl)phosphine;m-(Diphenylphosphino)benzenesulfonic acid; |
Article Data | 3 |
Benzenesulfonicacid, 3-(diphenylphosphino)- Specification
The CAS registry number of Benzenesulfonicacid, 3-(diphenylphosphino)- is 16704-71-5. This chemical is also named as Benzenesulfonicacid, m-(diphenylphosphino)- (8CI). In addition, its molecular formula is C18H15O3PS and molecular weight is 342.3487. Its systematic name is called 3-(diphenylphosphanyl)benzenesulfonic acid.
Physical properties about Benzenesulfonicacid, 3-(diphenylphosphino)- are: (1)ACD/LogP: 3.94; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.44; (4)ACD/LogD (pH 7.4): 0.44; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1.05; (8)ACD/KOC (pH 7.4): 1.05; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4.
You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(O)c3cc(P(c1ccccc1)c2ccccc2)ccc3
(2)InChI: InChI=1/C18H15O3PS/c19-23(20,21)18-13-7-12-17(14-18)22(15-8-3-1-4-9-15)16-10-5-2-6-11-16/h1-14H,(H,19,20,21)
(3)InChIKey: ITPOKAFWZBFZCV-UHFFFAOYAN
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