Basic information
- CAS
6224-63-1- Standard SMILES
Cc1cccc(P(c2cccc(C)c2)c2cccc(C)c2)c1- InChIKey
LFNXCUNDYSYVJY-UHFFFAOYSA-N- Molecular formula
- C21H21P
- Average molar mass
- 304.4 g/mol
- Monoisotopic mass
- 304.13808767
Names & identifiers
- Preferred name
- Tri-m-tolylphosphine
- IUPAC
- tris(3-methylphenyl)phosphane
- English name
- TRI-M-TOLYLPHOSPHINE
- Molecular formula
- C21H21P
- Molecular weight
- 304.37
Names & synonyms
Tri-m-tolylphosphine6224-63-1Tris(3-methylphenyl)phosphineTris(m-tolyl)phosphinePhosphine, tris(3-methylphenyl)-Tris(3-tolyl)phosphineSAQ9Z5ZSC8EINECS 228-312-4DTXSID3064146TRIS(3-TOLUENE)PHOSPHINERefChem:898982DTXCID8043284
Show more names
Tri-M-tolylTris(3-methyLTri-M-tolylphosphinTri-m-tolyphosphinetri(3-Tolyl)phosphinePHOSPHORUS TRI-M-TOLYL
228-312-4Tri(m-tolyl)phosphinetris(3-methylphenyl)phosphanePhosphine, tri-m-tolyl-MFCD00008532SCHEMBL49786TRI-M-TOLYL-PHOSPHANEtri-m-tolylphosphane
Database identifiers
- CAS
6224-63-1- PubChem CID
- 80362
- DTXSID
DTXSID3064146- UNII
- SAQ9Z5ZSC8
- EC Number
- 228-312-4
- Nikkaji
- J35.499F
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 286
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical shift
Physicochemical properties
- Melting point
- 97 · 97-99 °C(lit.)
- Boiling point
- 423.1 · 423.1±44.0 °C(Predicted)
- storage temp.
- Inert atmosphere,Room Temperature
- form
- crystal
- color
- white
- Water Solubility
- Insoluble in water.
- Sensitive
- Air Sensitive
- BRN
- 658863 · 658863
- InChI
- InChI=1S/C21H21P/c1-16-7-4-10-19(13-16)22(20-11-5-8-17(2)14-20)21-12-6-9-18(3)15-21/h4-15H,1-3H3
- InChIKey
- LFNXCUNDYSYVJY-UHFFFAOYSA-N
- SMILES
- P(C1=CC=CC(C)=C1)(C1=CC=CC(C)=C1)C1=CC=CC(C)=C1
- CAS DataBase Reference
- 6224 · 6224-63-1(CAS DataBase Reference)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 80 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- F
- 10-23
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 29319090
- risk_code
- 36/37/38-38-37-36
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPhosphine, tris(3-methylphenyl)-: ACTIVE
Applications
Usessuzuki reaction
UsesTri-m-tolylphosphine acts as a reagent for the preparation, crystal structure, multinuclear NMR, antitumor activity, photolysis of silver methylxanthate complexes against human adrenocarcinoma breast cancer cells.
Upstream & downstream products
Upstream raw materials
Suppliers100 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
INTATRADE GmbH
Related reactions
8 records
Compound notes
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