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614-34-6

614-34-6 Structure

614-34-6 Structure
IdentificationBack Directory
[Name]

P-TOLYL BENZOATE
[CAS]

614-34-6
[Synonyms]

p-Tolylbenzoat
P-TOLYL BENZOATE
4-cresylbenzoate
p-cresolbenzoate
p-cresylbenzoate
p-Cresyl benzoate
PARA-CRESYLBENZOATE
4-METHYLPHENYL BENZOATE
benzoicacid,p-tolylester
Benzoic acid, 4-tolyl ester
Benzoic acid, p-tolyl ester
Benzoicacid,4-methylphenylester
[EINECS(EC#)]

210-380-1
[Molecular Formula]

C14H12O2
[MDL Number]

MFCD00025982
[MOL File]

614-34-6.mol
[Molecular Weight]

212.24
Chemical PropertiesBack Directory
[Melting point ]

70-72 °C(lit.)
[Boiling point ]

316°C (estimate)
[density ]

1.1035 (rough estimate)
[refractive index ]

1.6000 (estimate)
[form ]

solid
[LogP]

3.590
[EPA Substance Registry System]

p-Tolyl benzoate (614-34-6)
Safety DataBack Directory
[WGK Germany ]

2
[RTECS ]

DH7050000
[Safety Profile]

Moderately toxic by ingestion. A skin irritant. When heated to decomposition it emits acrid smoke and irritating fumes.
Hazard InformationBack Directory
[Chemical Properties]

p-Tolyl Benzoate is a colorless or white plate crystals. M.P. 72℃. BP. 316℃. Insoluble in water, modestly soluble in alcohol, miscible with most perfume oils. Very faint odor, somewhat sweeter than that of para-Cresylsalicy late, more floral.
[Uses]

p-Tolyl Benzoate is rarely used in perfumes, occasionally as a fixative-modifier in Lily -Jasmin-Narcissus type bases.
[Preparation]

From para-Cresol sodium and Benzoyl chloride.
[General Description]

4-Methylphenyl benzoate is an ester. Structure of 4-methylphenyl benzoate resembles phenyl benzoate and 4-methoxy-phenyl benzoate, in terms of similar geometric parameters. The dihedral angle between the phenyl and benzene rings in 4-methylphenyl benzoate is 60.17 (7)°. Fries rearrangement of 4-methoxy-phenyl benzoate catalyzed by sulfated zirconia is reported.
Spectrum DetailBack Directory
[Spectrum Detail]

P-TOLYL BENZOATE(614-34-6)1HNMR
P-TOLYL BENZOATE(614-34-6)IR
P-TOLYL BENZOATE(614-34-6)Raman
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