Cas no 528-35-8 ((+-)-delta-Truxinsaeure)
(+-)-delta-Truxinsaeure structure
Product Name:(+-)-delta-Truxinsaeure
CAS No:528-35-8
MF:C18H16O4
MW:296.317245483398
CID:2057141
PubChem ID:27431029
Update Time:2025-04-21
(+-)-delta-Truxinsaeure Chemical and Physical Properties
Names and Identifiers
-
- (+-)-delta-Truxinsaeure
- 3c,4t-Diphenyl-cyclobutan-1r,2t-dicarbonsaeure
- 3c,4t-diphenyl-cyclobutane-1r,2t-dicarboxylic acid
- delta-Truxinsaeure
- dl-delta-Truxinsaeure
- opt.-inakt. 3c.4t-Diphenyl-cyclobutan-dicarbonsaeure-(1c.2t)
- 528-35-8
- DTXSID901175100
- Rel-(1S,2S,3S,4S)-3,4-diphenylcyclobutane-1,2-dicarboxylic acid
- mu-Truxinic acid
-
- Inchi： 1S/C18H16O4/c19-17(20)15-13(11-7-3-1-4-8-11)14(16(15)18(21)22)12-9-5-2-6-10-12/h1-10,13-16H,(H,19,20)(H,21,22)/t13-,14-,15-,16-/m0/s1
- InChI Key： QVNDSQQNODQYJM-VGWMRTNUSA-N
- SMILES： OC([C@@H]1[C@@H](C(=O)O)[C@@H](C2C=CC=CC=2)[C@@H]1C1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 296.10485899Da
- Monoisotopic Mass: 296.10485899Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 22
- Rotatable Bond Count: 4
- Complexity: 381
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 4
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.6
- Topological Polar Surface Area: 74.6?2
(+-)-delta-Truxinsaeure Related Literature
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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Martin R. Ward,Gary W. Copeland,Andrew J. Alexander Chem. Commun., 2010,46, 7634-7636
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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4. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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