Cas no 71523-05-2 (Benzoic acid, 4-(3,5-dimethyl-4-pyridinyl)-, ethyl ester)
71523-05-2 structure
Product Name:Benzoic acid, 4-(3,5-dimethyl-4-pyridinyl)-, ethyl ester
CAS No:71523-05-2
MF:C16H17NO2
MW:255.311684370041
CID:1753130
Update Time:2024-11-27
Benzoic acid, 4-(3,5-dimethyl-4-pyridinyl)-, ethyl ester Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid, 4-(3,5-dimethyl-4-pyridinyl)-, ethyl ester
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- Inchi： 1S/C16H17NO2/c1-4-19-16(18)14-7-5-13(6-8-14)15-11(2)9-17-10-12(15)3/h5-10H,4H2,1-3H3
- InChI Key： SBZLHTAKFGHAGY-UHFFFAOYSA-N
- SMILES： C(OCC)(=O)C1=CC=C(C2C(C)=CN=CC=2C)C=C1
Computed Properties
- Exact Mass: 255.12601
Experimental Properties
- Density: 1.086±0.06 g/cm3(Predicted)
- Boiling Point: 359.9±30.0 °C(Predicted)
- PSA: 39.19
- pka: 5.53±0.28(Predicted)
Benzoic acid, 4-(3,5-dimethyl-4-pyridinyl)-, ethyl ester Related Literature
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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