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Bis(3,5-dimethyl-4-methoxyphenyl)chlorophosphine - 95%, high purity , CAS No.136802-85-2
Basic Description
| Synonyms | CS-0106835 | J-006913 | FT-0770222 | DTXSID50402474 | AKOS015910269 | Phosphinous chloride, P,P-bis(4-methoxy-3,5-dimethylphenyl)- | SCHEMBL459763 | BIS(3,5-DIMETHYL-4-METHOXYPHENYL)CHLOROPHOSPHINE | Ethyl2,2-difluoroacetoacetate | MFCD01630810 | Bis(3,5- |
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| Specifications & Purity | ≥95% |
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| Product Description | Application Reactant for: Asymmetric organocatalytic electrophilic phosphination Asymmetric hydroformulation using Taddol-based chiral phosphine-phosphite ligands Synthesis of ferrocene-based chiral diphosphines Alcoholysis of phosphane-boranes Asymmetric hydrogenations of bifep-type biferrocenes |
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Names and Identifiers
| IUPAC Name | chloro-bis(4-methoxy-3,5-dimethylphenyl)phosphane |
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| INCHI | InChI=1S/C18H22ClO2P/c1-11-7-15(8-12(2)17(11)20-5)22(19)16-9-13(3)18(21-6)14(4)10-16/h7-10H,1-6H3 |
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| InChi Key | JWCZKGYRAINWJA-UHFFFAOYSA-N |
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| Canonical SMILES | CC1=CC(=CC(=C1OC)C)P(C2=CC(=C(C(=C2)C)OC)C)Cl |
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| Isomeric SMILES | CC1=CC(=CC(=C1OC)C)P(C2=CC(=C(C(=C2)C)OC)C)Cl |
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| WGK Germany | 3 |
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| PubChem CID | 4368797 |
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| Molecular Weight | 336.79 |
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Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
| Flash Point(°F) | >230 °F |
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| Flash Point(°C) | >110 °C |
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| Molecular Weight | 336.800 g/mol |
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| XLogP3 | 5.200 |
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| Hydrogen Bond Donor Count | 0 |
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| Hydrogen Bond Acceptor Count | 2 |
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| Rotatable Bond Count | 4 |
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| Exact Mass | 336.105 Da |
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| Monoisotopic Mass | 336.105 Da |
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| Topological Polar Surface Area | 18.500 Ų |
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| Heavy Atom Count | 22 |
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| Formal Charge | 0 |
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| Complexity | 298.000 |
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| Isotope Atom Count | 0 |
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| Defined Atom Stereocenter Count | 0 |
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| Undefined Atom Stereocenter Count | 0 |
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| Defined Bond Stereocenter Count | 0 |
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| Undefined Bond Stereocenter Count | 0 |
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| The total count of all stereochemical bonds | 0 |
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| Covalently-Bonded Unit Count | 1 |
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Safety and Hazards(GHS)
| Pictogram(s) | GHS05 |
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| Signal | Danger |
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| Hazard Statements | H314:Causes severe skin burns and eye damage |
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| Precautionary Statements | P280:Wear protective gloves/protective clothing/eye protection/face protection. P321:Specific treatment (see ... on this label). P405:Store locked up. P501:Dispose of contents/container to ... P264:Wash hands [and …] thoroughly after handling. P260:Do not breathe dust/fume/gas/mist/vapors/spray. P301+P330+P331:IF SWALLOWED: Rinse mouth. Do NOT induce vomiting. P304+P340:IF INHALED: Remove person to fresh air and keep comfortable for breathing. P363:Wash contaminated clothing before reuse. P305+P354+P338:IF IN EYES: Immediately rinse with water for several minutes. Remove contact lenses if present and easy to do. Continue rinsing. P302+P361+P354:IF ON SKIN: Take off Immediately all contaminated clothing. Immediately rinse with water for several minutes. P316:Get emergency medical help immediately. |
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| WGK Germany | 3 |
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| RIDADR | UN17608/PGIII |
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