Cas no 54549-74-5 (Benzaldehyde, 4-[(acetyloxy)methyl]-)
54549-74-5 structure
Product Name:Benzaldehyde, 4-[(acetyloxy)methyl]-
CAS No:54549-74-5
MF:C10H10O3
MW:178.184603214264
CID:354265
PubChem ID:539585
Update Time:2025-04-19
Benzaldehyde, 4-[(acetyloxy)methyl]- Chemical and Physical Properties
Names and Identifiers
-
- Benzaldehyde, 4-[(acetyloxy)methyl]-
- (4-formylphenyl)methyl acetate
- Acetic acid 4-formylbenzyl ester
- SCHEMBL3082528
- 4-Acetoxymethylbenzaldehyde
- 4-Formylbenzyl acetate #
- DTXSID20337183
- 4-[acetyloxy-methyl]benzaldehyde
- 54549-74-5
-
- Inchi: 1S/C10H10O3/c1-8(12)13-7-10-4-2-9(6-11)3-5-10/h2-6H,7H2,1H3
- InChI Key: JWHGCTVSBCLLCJ-UHFFFAOYSA-N
- SMILES: O(C(C)=O)CC1C=CC(C=O)=CC=1
Computed Properties
- Exact Mass: 178.063
- Monoisotopic Mass: 178.062994177g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 181
- 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: 1.4
- Topological Polar Surface Area: 43.4?2
Experimental Properties
- PSA: 43.37
Benzaldehyde, 4-[(acetyloxy)methyl]- Related Literature
-
Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
54549-74-5 (Benzaldehyde, 4-[(acetyloxy)methyl]-) Related Products
- 120-51-4(Benzyl benzoate)
- 1679-64-7(Mono-Methyl terephthalate)
- 87-24-1(Ethyl 2-methylbenzoate)
- 99-75-2(Methyl p-Toluate)
- 1459-93-4(Dimethyl isophthalate)
- 1877-71-0(Monomethyl Isophthalate)
- 94-08-6(Ethyl p-toluate)
- 99-36-5(Methyl 3-methylbenzoate)
- 140-11-4(Benzyl acetate)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
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