Cas no 51079-96-0 (2,4,6-Heptatrienal, 7-(4-methoxyphenyl)-)
51079-96-0 structure
Product Name:2,4,6-Heptatrienal, 7-(4-methoxyphenyl)-
CAS No:51079-96-0
MF:C14H14O2
MW:214.259764194489
CID:363323
PubChem ID:54517371
Update Time:2025-04-19
2,4,6-Heptatrienal, 7-(4-methoxyphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2,4,6-Heptatrienal, 7-(4-methoxyphenyl)-
- 7-(4-methoxyphenyl)hepta-2,4,6-trienal
- 51079-96-0
- DTXSID10711897
-
- Inchi: 1S/C14H14O2/c1-16-14-10-8-13(9-11-14)7-5-3-2-4-6-12-15/h2-12H,1H3
- InChI Key: YNILUQLYKFAYIY-UHFFFAOYSA-N
- SMILES: O(C)C1C=CC(C=CC=CC=CC=O)=CC=1
Computed Properties
- Exact Mass: 214.09942
- Monoisotopic Mass: 214.099379685g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 5
- Complexity: 269
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 3
- XLogP3: 3.1
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
2,4,6-Heptatrienal, 7-(4-methoxyphenyl)- Related Literature
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Shivani Sharma,Chia-Ming Wu,Ranjit T. Koodali,N. Rajesh RSC Adv., 2016,6, 26668-26678
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
-
Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
51079-96-0 (2,4,6-Heptatrienal, 7-(4-methoxyphenyl)-) Related Products
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