4-<i>tert</i>-Butylbenzonitrile , >98.0%(GC) , 4210-32-6

CAS NO.：4210-32-6

Empirical Formula: C11H13N

Molecular Weight: 159.23

MDL number: MFCD00075840

EINECS: 224-137-2

PRODUCT Properties

• Melting point: 12-14 °C
• Boiling point: 258 °C(lit.)
• Density: 0.94 g/mL at 25 °C(lit.)
• refractive index: n20/D 1.518(lit.)
• Flash point: >230 °F
• storage temp.: Sealed in dry,Room Temperature
• form: clear liquid
• color: Colorless to Light yellow
• Specific Gravity: 0.95
• BRN: 2080049
• InChI: InChI=1S/C11H13N/c1-11(2,3)10-6-4-9(8-12)5-7-10/h4-7H,1-3H3
• InChIKey: IIZURLNRIMKEDL-UHFFFAOYSA-N
• SMILES: C(#N)C1=CC=C(C(C)(C)C)C=C1
• LogP: 3.49
• CAS DataBase Reference: 4210-32-6(CAS DataBase Reference)
• NIST Chemistry Reference: 4-t-Butylbenzonitrile(4210-32-6)

Description and Uses

4-tert-Butylbenzonitrile may be used to synthesize 3-bromo-4′-tert-butylbenzophenone.

Safety

• Symbol(GHS): GHS07,GHS06
• Signal word: Warning
• Hazard statements: H302-H301+H311+H331-H312-H319-H332
• Precautionary statements: P280-P305+P351+P338-P280h-P301+P312a-P304+P340-P321-P501a-P261-P264-P270-P271-P301+P310+P330-P302+P352+P312+P361+P364-P304+P340+P311-P403+P233-P405-P501
• Hazard Codes: Xn,Xi
• Risk Statements: 20/21/22
• Safety Statements: 36-36/37
• RIDADR: 3276
• WGK Germany: 2
• Hazard Note: Irritant
• HazardClass: 6.1
• PackingGroup: III
• HS Code: 29269090