Cas no 64144-75-8 (17-Octadecene-10,12-diynoic acid, 8-hydroxy-)
64144-75-8 structure
Product Name:17-Octadecene-10,12-diynoic acid, 8-hydroxy-
CAS No:64144-75-8
MF:C18H26O3
MW:290.397245883942
CID:424885
PubChem ID:5312841
Update Time:2025-04-19
17-Octadecene-10,12-diynoic acid, 8-hydroxy- Chemical and Physical Properties
Names and Identifiers
-
- 17-Octadecene-10,12-diynoic acid, 8-hydroxy-
- 8-hydroxyoctadec-17-en-10,12-diynoic acid
- CHEBI:190368
- DTXSID90415609
- 8-hydroxy-17-octadecene-10,12-diynoic acid
- 64144-75-8
- LMFA02000201
-
- Inchi： 1S/C18H26O3/c1-2-3-4-5-6-7-8-11-14-17(19)15-12-9-10-13-16-18(20)21/h2,17,19H,1,3-5,9-10,12-16H2,(H,20,21)
- InChI Key： MKFHJJAOYAVQNC-UHFFFAOYSA-N
- SMILES： OC(CC#CC#CCCCC=C)CCCCCCC(=O)O
Computed Properties
- Exact Mass: 290.18828
- Monoisotopic Mass: 290.18819469g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 21
- Rotatable Bond Count: 12
- Complexity: 424
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.3
- Topological Polar Surface Area: 57.5?2
Experimental Properties
- PSA: 57.53
17-Octadecene-10,12-diynoic acid, 8-hydroxy- Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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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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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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