Cas no 349392-84-3 (Benzamide,3,5-diethyl-N,2-dihydroxy-)
349392-84-3 structure
Product Name:Benzamide,3,5-diethyl-N,2-dihydroxy-
CAS No:349392-84-3
MF:C11H15NO3
MW:209.241703271866
CID:302762
PubChem ID:45094932
Update Time:2025-04-19
Benzamide,3,5-diethyl-N,2-dihydroxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzamide,3,5-diethyl-N,2-dihydroxy-
- Benzamide, 3,5-diethyl-N,2-dihydroxy- (9CI)
- 3,5-diethyl-N,2-dihydroxybenzamide
- 349392-84-3
- DTXSID20667336
-
- Inchi： 1S/C11H15NO3/c1-3-7-5-8(4-2)10(13)9(6-7)11(14)12-15/h5-6,13,15H,3-4H2,1-2H3,(H,12,14)
- InChI Key： QVCRYNPKZDXJHR-UHFFFAOYSA-N
- SMILES： OC1=C(C(NO)=O)C=C(CC)C=C1CC
Computed Properties
- Exact Mass: 209.10525
- Monoisotopic Mass: 209.105
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 220
- 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: 69.6A^2
- XLogP3: 2.5
Experimental Properties
- PSA: 69.56
Benzamide,3,5-diethyl-N,2-dihydroxy- Related Literature
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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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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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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