Cas no 126639-26-7 (9-Undecenoic acid, 11-(3-pentyl-2-oxiranyl)-)
126639-26-7 structure
Product Name:9-Undecenoic acid, 11-(3-pentyl-2-oxiranyl)-
CAS No:126639-26-7
MF:C18H32O3
MW:296.444886207581
CID:165741
Update Time:2023-08-03
9-Undecenoic acid, 11-(3-pentyl-2-oxiranyl)- Chemical and Physical Properties
Names and Identifiers
-
- 9-Undecenoic acid,11-[(2R,3S)-3-pentyl-2-oxiranyl]-, (9Z)-rel-
- 9-Undecenoic acid,11-[(2R,3S)-3-pentyloxiranyl]-, (9Z)-rel- (9CI)
- 9-Undecenoicacid, 11-(3-pentyloxiranyl)-, [2a(Z),3a]-
- cis-12,13-Epoxyoleic acid
- Isoleukotoxin
- Leukotoxin B
- NCIOpen2_002285
- CBiol_001810
- KBioGR_000082
- KBioSS_000082
- KBio3_000163
- KBio2_005218
- KBio2_000082
- KBio3_000164
- KBio2_002650
- Bio2_000082
- Bio1_000585
- Bio2_000562
- Bio1_001074
- Bio1_000096
- 12,13-epoxy-octadeca-9-enoic acid
- 9-Undecenoic acid, 11-(3-pentyl-2-oxiranyl)-
-
- Inchi： 1S/C18H32O3/c1-2-3-10-13-16-17(21-16)14-11-8-6-4-5-7-9-12-15-18(19)20/h8,11,16-17H,2-7,9-10,12-15H2,1H3,(H,19,20)
- InChI Key： CCPPLLJZDQAOHD-UHFFFAOYSA-N
- SMILES： O1C(CC=CCCCCCCCC(=O)O)C1CCCCC
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 21
- Rotatable Bond Count: 14
- Complexity: 299
- Topological Polar Surface Area: 49.8
9-Undecenoic acid, 11-(3-pentyl-2-oxiranyl)- Related Literature
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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