| Identification | More | [Name]
4-tert-Butylbenzoyl chloride | [CAS]
1710-98-1 | [Synonyms]
4-(1,1-Dimethylethyl)-Benzoyl chloride
4-TERT-BUTYLBENZOYL CHLORIDE
P-T-BUTYLBENZOYL CHLORIDE
P-TERT-BUTYLBENZOYL CHLORIDE
4-(1,1-dimethylethyl)-benzoylchlorid
Benzoylchloride,4-(1,1-dimethylethyl)-
Benzoylchloride,p-tert-butyl-
butylbenzoylchloride
4-tert-Butylbenzoyl chloride, 98+%
4-TERT-BTUYLBENZOYLCHLORIDE
4-tert-Butylbenzoic acid chloride | [EINECS(EC#)]
216-973-1 | [Molecular Formula]
C11H13ClO | [MDL Number]
MFCD00000695 | [Molecular Weight]
196.67 | [MOL File]
1710-98-1.mol |
| Chemical Properties | Back Directory | [Appearance]
CLEAR COLOURLESS TO VERY SLIGHTLY YELLOW LIQUID | [Melting point ]
177.5-179 °C(Solv: ligroine (8032-32-4); dichloromethane (75-09-2)) | [Boiling point ]
135 °C20 mm Hg(lit.)
| [density ]
1.007 g/mL at 25 °C(lit.)
| [refractive index ]
n20/D 1.536(lit.)
| [Fp ]
190 °F
| [storage temp. ]
Store below +30°C. | [form ]
Liquid | [color ]
Clear colorless to very slightly yellow | [Water Solubility ]
Reacts with water. | [Sensitive ]
Moisture Sensitive | [BRN ]
775793 | [InChI]
1S/C11H13ClO/c1-11(2,3)9-6-4-8(5-7-9)10(12)13/h4-7H,1-3H3 | [InChIKey]
WNLMYNASWOULQY-UHFFFAOYSA-N | [SMILES]
CC(C)(C)c1ccc(cc1)C(Cl)=O | [CAS DataBase Reference]
1710-98-1(CAS DataBase Reference) | [NIST Chemistry Reference]
Benzoyl chloride, 4-(1,1-dimethylethyl)-(1710-98-1) | [EPA Substance Registry System]
1710-98-1(EPA Substance) |
| Safety Data | Back Directory | [Hazard Codes ]
C | [Risk Statements ]
R34:Causes burns.
R37:Irritating to the respiratory system. | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S24/25:Avoid contact with skin and eyes . | [RIDADR ]
UN 3265 8/PG 2
| [WGK Germany ]
3
| [F ]
9-21 | [TSCA ]
Yes | [HazardClass ]
8 | [PackingGroup ]
II | [HS Code ]
29163900 | [Storage Class]
8A - Combustible corrosive hazardous materials | [Hazard Classifications]
Eye Dam. 1
Skin Corr. 1B |
| Hazard Information | Back Directory | [Chemical Properties]
CLEAR COLOURLESS TO VERY SLIGHTLY YELLOW LIQUID | [Uses]
4-tert-Butylbenzoyl chloride is used as a reactant in the preparation of multi-branched structures based on triphenylamine for enhanced two-photon absorption. | [General Description]
AlCl3 promoted Friedel-Crafts acylation of 4-tert-butylbenzoyl chloride with mesitylene was investigated. | [Purification Methods]
Distil it in a vacuum. If IR shows OH group, then treat it with thionyl chloride or oxalyl chloride at ca 50o for 30minutes, evaporate and fractionate it in a vacuum using a short column. Strongly LACHRYMATORY; use a good fume hood. [Fuson & Turnbull J Am Chem Soc 71 2544 1949, Tsuno et al. Bull Chem Soc Jpn 32 960 1959, Swain et al. J Am Chem Soc 72 5433 1950, Beilstein 9 III 2526.] |
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