Identification | More | [Name]
4-BENZOYLBUTYRIC ACID | [CAS]
1501-05-9 | [Synonyms]
4-BENZOYLBUTYRIC ACID 5-OXO-5-PHENYLPENTANOIC ACID 5-OXO-5-PHENYLVALERIC ACID AKOS BB-9265 LABOTEST-BB LT00645576 TIMTEC-BB SBB007811 4-(4'-benzoyl)butyric acid 5-OXO-5-PHENYLVALERIC ACID 95+% 4-Benzoylbutyric acid, 98+% 4-Benzoylbutanoic acid 5-Phenyl-5-oxopentanoic acid 5-Phenyl-5-oxypentanoic acid δ-Oxobenzenepentanoic acid δ-Oxobenzenevaleric acid | [EINECS(EC#)]
216-113-5 | [Molecular Formula]
C11H12O3 | [MDL Number]
MFCD00004411 | [Molecular Weight]
192.21 | [MOL File]
1501-05-9.mol |
Chemical Properties | Back Directory | [Appearance]
off-white to light beige crystalline powder | [Melting point ]
126-129 °C(lit.)
| [Boiling point ]
380.8±25.0 °C(Predicted) | [density ]
1.164±0.06 g/cm3(Predicted) | [form ]
Crystalline Powder | [pka]
4.63±0.10(Predicted) | [color ]
Off-white to light beige | [Water Solubility ]
Insoluble in water. | [BRN ]
641947 | [InChIKey]
SHKWSBAVRQZYLE-UHFFFAOYSA-N | [CAS DataBase Reference]
1501-05-9(CAS DataBase Reference) |
Safety Data | Back Directory | [Hazard Codes ]
Xi | [Risk Statements ]
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice . S36:Wear suitable protective clothing . | [WGK Germany ]
3
| [HS Code ]
29183000 |
Hazard Information | Back Directory | [Chemical Properties]
off-white to light beige crystalline powder | [Uses]
4-Benzoylbutyric acid is an important raw material and intermediate used in organic synthesis, pharmaceuticals, agrochemicals and dyestuff fields. | [Synthesis Reference(s)]
Journal of the American Chemical Society, 73, p. 5273, 1951 DOI: 10.1021/ja01155a078 |
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