Tris(4-chlorophenyl)phosphine (HCID 70874)

Names & identifiers

Preferred name: Tris(4-chlorophenyl)phosphine
IUPAC: tris(4-chlorophenyl)phosphane
English name: Tris(4-chlorophenyl)phosphine
Molecular formula: C18H12Cl3P
Molecular weight: 365.62

Names & synonyms

Tris(4-chlorophenyl)phosphine1159-54-2Phosphine, tris(4-chlorophenyl)-Tris(p-chlorophenyl)phosphinetri(p-Chlorophenyl)phosphinetri-(4-Chlorophenyl)phosphinePhosphine, tris(p-chlorophenyl)-EINECS 214-596-7DTXSID30151216Phosphine, tris[4-chlorophenyl]-NSC 136459RefChem:192104

Show more names

Tri(p-chlorophenTris(4-chlorophenyl)TRI(4-CHLOROPHENYL)PHOSPHINERIS(4-CHLOROPHENYL)PHOSPHINETris(p-chlorophenyl)phosphane

DTXCID9073707214-596-7IQKSLJOIKWOGIZ-UHFFFAOYSA-Ntris(4-chlorophenyl)phosphaneMFCD00013639NSC136459DWG5LE6Q8XNSC-136459

Database identifiers

CAS: 1159-54-2
PubChem CID: 70874
DTXSID: DTXSID30151216
UNII: DWG5LE6Q8X
EC Number: 214-596-7
Nikkaji: J203.418B

Properties

Computed structural properties

XLogP: 6.5
Topological polar surface area: 0 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 0
Rotatable bonds: 3
Heavy atoms: 22
Formal charge: 0
Complexity: 275

Physicochemical properties

Melting point: 100 · 100-103 °C (lit.)
Boiling point: 427.6 · 427.6±40.0 °C(Predicted)
storage temp.: Inert atmosphere,Room Temperature
form: crystal
color: white
Sensitive: Air Sensitive
BRN: 751458 · 751458
InChI: 1S/C18H12Cl3P/c19-13-1-7-16(8-2-13)22(17-9-3-14(20)4-10-17)18-11-5-15(21)6-12-18/h1-12H
InChIKey: IQKSLJOIKWOGIZ-UHFFFAOYSA-N
SMILES: Clc1ccc(cc1)P(c2ccc(Cl)cc2)c3ccc(Cl)cc3
CAS DataBase Reference: 1159 · 1159-54-2(CAS DataBase Reference)
FDA UNII: 5 LE6Q8X · DWG5LE6Q8X
UNSPSC Code: 12352101 · 12352101
NACRES: 22 · NA.22
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
target organs: Respiratory system
PPE: 95 · dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38
Safety Statements: 26 · 26-37/39
RIDADR: 3278 · 3278
WGK Germany: 3 · 3
TSCA: No
PackingGroup: III
HS Code: 29310099 · 29310099
Storage Class: 11 · 11 - Combustible Solids
Hazard Classifications: 2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3

Safety & regulation

GHS classification

GHS Classification · 5 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.8%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 46 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (97.8%)

Safety data

PPE: dust mask type N95 (US), Eyeshields, Gloves
wgk: 3
tsca: No
ridadr: 3278
hs_code: 29310099
risk_code: 36/37/38
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
safety_code: 26-37/39
Storage Class: 11 - Combustible Solids
packing_group: III
target organs: Respiratory system
Hazard statements: H315-H319-H335
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
Precautionary statements: P261-P264-P271-P280-P302+P352-P305+P351+P338

Chemistry & industry

Applications · 1 item

UsesCatalyst for:Preparation of chromans and (E,E)-1,3-dienes via reaction of γ-substituted allenoates with aldehydesSolvent-free Heck reactionsCocatalyst in:Regioselective carbomagnesiation of terminal alkynes and enynes with alkyl Grignard reagentsRhodium-catalyzed coordination-assisted regioselective alkenylation of aromatic C-H bonds with terminal silylacetylenesRhodium-catalyzed hydrogenation reactionsPlatinum-catalyzed allylation reactions