Cas no 1058161-67-3 ((4-Phenethyloxyphenyl)acetic acid methyl ester)
1058161-67-3 structure
Product Name:(4-Phenethyloxyphenyl)acetic acid methyl ester
CAS No:1058161-67-3
MF:C17H18O3
MW:270.323025226593
CID:2137740
Update Time:2023-08-04
(4-Phenethyloxyphenyl)acetic acid methyl ester Chemical and Physical Properties
Names and Identifiers
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- (4-phenethyloxyphenyl)acetic acid methyl ester
- (4-Phenethyloxyphenyl)acetic acid methyl ester
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- Inchi： 1S/C17H18O3/c1-19-17(18)13-15-7-9-16(10-8-15)20-12-11-14-5-3-2-4-6-14/h2-10H,11-13H2,1H3
- InChI Key： OMCZIHDEDLWOFO-UHFFFAOYSA-N
- SMILES： O(C1C=CC(=CC=1)CC(=O)OC)CCC1C=CC=CC=1
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 7
- Complexity: 276
- XLogP3: 3.8
- Topological Polar Surface Area: 35.5
(4-Phenethyloxyphenyl)acetic acid methyl ester Related Literature
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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