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tert-Butyl(triphenylphosphoranylidene)acetate

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tert-Butyl(triphenylphosphoranylidene)acetate

EINECS 412-880-7
CAS No. 35000-38-5 Density 1.13g/cm3
PSA 36.11000 LogP 4.12440
Solubility Sparingly soluble in water. Melting Point 152-155 °C(lit.)
Formula C24H25O2P Boiling Point 503.5 °C at 760 mmHg
Molecular Weight 376.435 Flash Point 271.4 °C
Transport Information UN 3464 Appearance white crystalline powder
Safety 26-36/37/39-45-61 Risk Codes 25-36-43-48/22-51/53
Molecular Structure Molecular Structure of 35000-38-5 (tert-Butyl(triphenylphosphoranylidene)acetate) Hazard Symbols
Synonyms

Aceticacid, (triphenylphosphoranylidene)-, 1,1-dimethylethyl ester (9CI);(Triphenyl-l5-phosphanylidene)acetic acidtert-butyl ester;(Triphenylphosphoranylidene)acetic acid tert-butyl ester;(tert-Butoxycarbonylmethylene)triphenylphosphoran;(tert-Butoxycarbonylmethylene)triphenylphosphorane;1,1-Dimethylethyl(triphenylphosphoranylidene)acetate;1,1-Dimethylethyl 2-(triphenyl-l5-phosphanylidene)acetate;NSC82469;Triphenyl(tert-butoxycarbonylmethylene)phosphorane;tert-Butyl2-(triphenylphosphoranylidene)acetate;

Article Data 40

tert-Butyl(triphenylphosphoranylidene)acetate Chemical Properties

Product Name: tert-Butyl(triphenylphosphoranylidene)acetate (CAS NO.35000-38-5)


Molecular Formula: C24H25O2P
Molecular Weight: 376.43g/mol
Mol File: 35000-38-5.mol
EINECS: 412-880-7
Melting Point: 152-155 °C(lit.)
Boiling point: 503.5 °C at 760 mmHg
Storage Temperature: Refrigerator (+4°C)
Flash Point: 271.4 °C
Density: 1.13 g/cm3
Surface Tension: 45.1 dyne/cm
Enthalpy of Vaporization: 77.27 kJ/mol
Vapour Pressure: 2.89E-10 mmHg at 25°C
Structure Descriptors of tert-Butyl(triphenylphosphoranylidene)acetate (CAS NO.35000-38-5):
  IUPAC Name: tert-butyl 2-triphenylphosphoranylideneacetate
  Canonical SMILES: CC(C)(C)OC(=O)C=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3
  InChI: InChI=1S/C24H25O2P/c1-24(2,3)26-23(25)19-27(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22/h4-19H,1-3H3 
  InChIKey: ZWZUFQPXYVYAFO-UHFFFAOYSA-N
Product Categories: API

tert-Butyl(triphenylphosphoranylidene)acetate Safety Profile

Safety Information of tert-Butyl(triphenylphosphoranylidene)acetate (CAS NO.35000-38-5):
Hazard Codes: TToxic,NDangerous
Risk Statements: 25-36-43-48/22-51/53 
22:  Harmful if swallowed  
25:  Toxic if swallowed 
36:  Irritating to the eyes 
43:  May cause sensitization by skin contact 
48:  Danger of serious damage to health by prolonged exposure 
51:  Toxic to aquatic organisms  
53:  May cause long-term adverse effects in the aquatic environment 
Safety Statements: 26-36/37/39-45-61
26:  In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36:  Wear suitable protective clothing  
37:  Wear suitable gloves 
39:  Wear eye/face protection 
45:  In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) 
61:  Avoid release to the environment. Refer to special instructions safety data sheet 
RIDADR: UN 3464 6.1/PG 2
WGK Germany: 3
HazardClass: 6.1
PackingGroup: III

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