Cas no 100482-26-6 (Benzoic acid,4-ethoxy-3,5-dipropyl-, ethyl ester)
100482-26-6 structure
Product Name:Benzoic acid,4-ethoxy-3,5-dipropyl-, ethyl ester
CAS No:100482-26-6
MF:C17H26O3
MW:278.386545658112
CID:175471
PubChem ID:57879
Update Time:2025-04-19
Benzoic acid,4-ethoxy-3,5-dipropyl-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid,4-ethoxy-3,5-dipropyl-, ethyl ester
- ethyl 4-ethoxy-3,5-dipropylbenzoate
- 3,5-Dipropyl-4-ethoxybenzoic acid ethyl ester
- 4-Aethoxy-3.5-dipropyl-benzoesaeure-aethylester
- AC1L1NVW
- AC1Q64FL
- ACMC-20m3ix
- BENZOIC ACID, 3,5-DIPROPYL-4-ETHOXY-, ETHYL ESTER
- BRN 2590799
- CTK3J8980
- DTXSID30143318
- 100482-26-6
-
- Inchi： 1S/C17H26O3/c1-5-9-13-11-15(17(18)20-8-4)12-14(10-6-2)16(13)19-7-3/h11-12H,5-10H2,1-4H3
- InChI Key： BXARXLWSBTVJNV-UHFFFAOYSA-N
- SMILES： O(CC)C1C(=CC(C(=O)OCC)=CC=1CCC)CCC
Computed Properties
- Exact Mass: 278.18828
- Monoisotopic Mass: 278.188195
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 9
- Complexity: 261
- 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
- Topological Polar Surface Area: 35.5
- XLogP3: 5.2
Experimental Properties
- Density: 0.983
- Boiling Point: 380.5°Cat760mmHg
- Flash Point: 159.9°C
- Refractive Index: 1.493
- PSA: 35.53
- LogP: 4.16700
Benzoic acid,4-ethoxy-3,5-dipropyl-, ethyl ester Related Literature
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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