Cas no 54699-32-0 (1,4-Benzenedicarboxylic acid, dodecyl ethyl ester)
54699-32-0 structure
Product Name:1,4-Benzenedicarboxylic acid, dodecyl ethyl ester
CAS No:54699-32-0
MF:C22H34O4
MW:362.502967357636
CID:2185202
Update Time:2023-08-05
1,4-Benzenedicarboxylic acid, dodecyl ethyl ester Chemical and Physical Properties
Names and Identifiers
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- 1,4-Benzenedicarboxylic acid 1-dodecyl 4-ethyl ester
- 1,4-Benzenedicarboxylic acid, dodecyl ethyl ester
- NUDDPKPUKLUAJQ-UHFFFAOYSA-N
- 1-Dodecyl 4-ethyl terephthalate #
-
- Inchi： 1S/C22H34O4/c1-3-5-6-7-8-9-10-11-12-13-18-26-22(24)20-16-14-19(15-17-20)21(23)25-4-2/h14-17H,3-13,18H2,1-2H3
- InChI Key： NUDDPKPUKLUAJQ-UHFFFAOYSA-N
- SMILES： O(C(C1C=CC(C(=O)OCC)=CC=1)=O)CCCCCCCCCCCC
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 26
- Rotatable Bond Count: 16
- Complexity: 372
- XLogP3: 8.1
- Topological Polar Surface Area: 52.6
1,4-Benzenedicarboxylic acid, dodecyl ethyl ester Related Literature
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1. An amorphous lanthanum–iridium solid solution with an open structure for efficient water splitting?Wei Sun,Chenglong Ma,Xinlong Tian,Jianjun Liao,Ji Yang,Chengjun Ge,Weiwei Huang J. Mater. Chem. A, 2020,8, 12518-12525
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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3. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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