Cas no 38743-20-3 (Octadienal)
Octadienal structure
Product Name:Octadienal
CAS No:38743-20-3
MF:C8H12O
MW:124.180282592773
CID:320966
Update Time:2026-05-14
Octadienal Chemical and Physical Properties
Names and Identifiers
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- Octadienal
-
- Inchi： InChI=1S/C8H12O/c1-2-3-4-5-6-7-8-9/h4-8H,2-3H2,1H3/b5-4+,7-6+
- InChI Key： DVVATNQISMINCX-YTXTXJHMSA-N
- SMILES： C(=O)/C=C/C=C/CCC
Computed Properties
- Exact Mass: 124.08886
- Monoisotopic Mass: 124.089
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 9
- Rotatable Bond Count: 4
- Complexity: 112
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 2
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 17.1A^2
Experimental Properties
- Color/Form: White or off white crystalline powder
- Density: 0.875
- Boiling Point: 88 °C10 mm Hg(lit.)
- Flash Point: 79 oC
- Refractive Index: n20/D 1.526(lit.)
- PSA: 17.07
- LogP: 2.09780
Octadienal Related Literature
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1. Formation and disappearance of aldehydes during simulated gastrointestinal digestion of fried clamsZhong-Yuan Liu,Yuan-Yuan Hu,Man-Tong Zhao,Hong-Kai Xie,Xiao-Pei Hu,Xiao-Chi Ma,Jiang-Hua Zhang,Yan-Hong Bai,Da-Yong Zhou Food Funct. 2020 11 3483
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Dong Han,Siyang Deng,Hang Wang,Feng Huang,Marie-Laure Fauconnier,Hong Li,Jian Zheng,Linchun Meng,Chunhui Zhang,Xia Li Food Funct. 2023 14 6554
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Yuanyuan Hu,Guanhua Zhao,Jialiang Wang,Zhongyuan Liu,Fawen Yin,Lei Qin,Dayong Zhou,Fereidoon Shahidi,Beiwei Zhu Food Funct. 2021 12 11046
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Yuanyuan Hu,Guanhua Zhao,Lei Qin,Zhenlong Yu,Min Zhang,Xiaochi Ma,Dayong Zhou,Fereidoon Shahidi,Beiwei Zhu Food Funct. 2021 12 5488
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Emily R. Brown,Marisa R. Cepeda,Samantha J. Mascuch,Kelsey L. Poulson-Ellestad,Julia Kubanek Nat. Prod. Rep. 2019 36 1093
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