Cas no 14617-92-6 (Butanoic acid,4-methylphenyl ester)
14617-92-6 structure
Product Name:Butanoic acid,4-methylphenyl ester
CAS No:14617-92-6
MF:C11H14O2
MW:178.227663516998
CID:167711
PubChem ID:84556
Update Time:2025-04-19
Butanoic acid,4-methylphenyl ester Chemical and Physical Properties
Names and Identifiers
-
- Butanoic acid,4-methylphenyl ester
- (4-methylphenyl) butanoate
- p-tolyl butyrate
- 4-Butyryloxy-toluol
- AC1L37PP
- Buttersaeure-p-tolylester
- Butyric acid, p-tolyl ester
- methyl-4-phenyl butyrate
- p-Cresyl butanoate
- P-CRESYL BUTYRATE
- p-cresyl n-butanoate
- p-Cresyl n-butyrate
- p-Tolyl-butyrat
- SureCN898796
- Ai3-18342
- Einecs 238-654-6
- para-cresyl butyrate
- Butyric acid 4-methylphenyl ester
- RRXBRABFDRJAPX-UHFFFAOYSA-
- Para-Cresylbutyrat
- NSC-53053
- RRXBRABFDRJAPX-UHFFFAOYSA-N
- SCHEMBL898796
- 14617-92-6
- AKOS006241576
- Butanoic acid, 4-methylphenyl ester
- 4-Methylphenyl butyrate #
- NSC53053
- NS00024774
- NSC 53053
- DTXSID90163279
- InChI=1/C11H14O2/c1-3-4-11(12)13-10-7-5-9(2)6-8-10/h5-8H,3-4H2,1-2H3
- Q63399379
-
- Inchi： 1S/C11H14O2/c1-3-4-11(12)13-10-7-5-9(2)6-8-10/h5-8H,3-4H2,1-2H3
- InChI Key： RRXBRABFDRJAPX-UHFFFAOYSA-N
- SMILES： O(C1C=CC(C)=CC=1)C(CCC)=O
Computed Properties
- Exact Mass: 178.09942
- Monoisotopic Mass: 178.09938
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 158
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.9
- Topological Polar Surface Area: 26.3
Experimental Properties
- Density: 1.01
- Boiling Point: 250.2°Cat760mmHg
- Flash Point: 95.4°C
- Refractive Index: 1.497
- PSA: 26.3
- LogP: 2.70050
Butanoic acid,4-methylphenyl ester Related Literature
-
Young-Do Kwon,Minh Thanh La,Hee-Kwon Kim New J. Chem. 2018 42 10833
-
2. Some derivatives of indan-1-one. Part IIW. Kemp,J. Spanswick J. Chem. Soc. Perkin Trans. 1 1972 151
-
3. XXXIII.—The formation and reactions of imino-compounds. Part VIII. The formation of methyl derivatives of 2-phenyl-1 : 3-naphthylenediamine from the three tolylacetonitrilesStanley Robert Best,Jocelyn Field Thorpe J. Chem. Soc. Trans. 1909 95 261
-
Weiming Eugene Siew,Celal Ates,Alain Merschaert,Andrew G. Livingston Green Chem. 2013 15 663
14617-92-6 (Butanoic acid,4-methylphenyl ester) Related Products
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