Cas no 13161-77-8 (3-Octadecenoic acid, (E)-)
3-Octadecenoic acid, (E)- structure
Product Name:3-Octadecenoic acid, (E)-
CAS No:13161-77-8
MF:C18H34O2
MW:282.461366176605
CID:1233191
PubChem ID:5282751
Update Time:2025-04-20
3-Octadecenoic acid, (E)- Chemical and Physical Properties
Names and Identifiers
-
- 3-Octadecenoic acid, (E)-
- octadec-3-enoic acid
- trans-3-octadecenoic acid
- LMFA01030063
- SCHEMBL995105
- CHEBI:196191
- DTXSID601312735
- 13161-77-8
- (E)-octadec-3-enoic acid
- 3-octadecenoic acid
- 3-octadecylenic acid
- SCHEMBL995106
- C18:1n-15
-
- Inchi： 1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h15-16H,2-14,17H2,1H3,(H,19,20)/b16-15-
- InChI Key： DLPRXTUOPLIHNV-NXVVXOECSA-N
- SMILES： CCCCCCCCCCCCCC/C=C\CC(=O)O
Computed Properties
- Exact Mass: 282.25602
- Monoisotopic Mass: 282.255880323g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 15
- Complexity: 234
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 7.7
- Topological Polar Surface Area: 37.3?2
Experimental Properties
- PSA: 37.3
3-Octadecenoic acid, (E)- Related Literature
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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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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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
13161-77-8 (3-Octadecenoic acid, (E)-) Related Products
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- 4219-24-3(3-Hexenoic acid)
- 15469-77-9(3-Decenoic acid)
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- 30418-89-4(2-Nonen-1-ol,1-acetate, (2E)-)
- 29901-85-7(3-Heptenoic acid)
- 1617-32-9((E)-Pent-3-enoic Acid)
- 1775-43-5(3-Hexenoic acid, (3Z)-)
- 1577-19-1(3-Octenoic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
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