Cas no 64019-95-0 (Alchornoic acid)
Alchornoic acid structure
Product Name:Alchornoic acid
CAS No:64019-95-0
MF:C20H36O3
MW:324.498046875
CID:517485
Update Time:2024-03-01
Alchornoic acid Chemical and Physical Properties
Names and Identifiers
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- 11-Tridecenoic acid,13-[(2S,3R)-3-pentyloxiranyl]-, (11Z)- (9CI)
- (Z)-13-[(2S,3R)-3-Pentyloxiran-2β-yl]-11-tridecenoic acid
- 11-Tridecenoicacid, 13-(3-pentyloxiranyl)-, [2S-[2a(Z),3a]]-
- Alchornoic acid
- Alchornic acid
- LMFA01070021
-
- Inchi： 1S/C20H36O3/c1-2-3-12-15-18-19(23-18)16-13-10-8-6-4-5-7-9-11-14-17-20(21)22/h10,13,18-19H,2-9,11-12,14-17H2,1H3,(H,21,22)/b13-10-/t18-,19+/m1/s1
- InChI Key： IQTLUAOJSNPZIR-QOLSVTOYSA-N
- SMILES： O1[C@@H](C/C=C\CCCCCCCCCC(=O)O)[C@H]1CCCCC
Computed Properties
- Exact Mass: 324.266
- Monoisotopic Mass: 324.266
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 23
- Rotatable Bond Count: 16
- Complexity: 325
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 49.8
Alchornoic acid Related Literature
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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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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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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