Cas no 16979-04-7 (Tridecanal, 2-oxo-)
Tridecanal, 2-oxo- structure
Product Name:Tridecanal, 2-oxo-
CAS No:16979-04-7
MF:C13H24O2
MW:212.328464508057
CID:213095
PubChem ID:167603
Update Time:2025-04-19
Tridecanal, 2-oxo- Chemical and Physical Properties
Names and Identifiers
-
- Tridecanal, 2-oxo-
- 2-oxotridecanal
- Undecylglyoxal
- 16979-04-7
- SCHEMBL10821138
- DTXSID10168746
-
- Inchi： 1S/C13H24O2/c1-2-3-4-5-6-7-8-9-10-11-13(15)12-14/h12H,2-11H2,1H3
- InChI Key： DVAOZVRRSPDKOH-UHFFFAOYSA-N
- SMILES： O=C(C=O)CCCCCCCCCCC
Computed Properties
- Exact Mass: 212.17772
- Monoisotopic Mass: 212.178
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 11
- Complexity: 164
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4
- Topological Polar Surface Area: 34.1?2
Experimental Properties
- Density: 0.893
- Boiling Point: 285.8°Cat760mmHg
- Flash Point: 112.3°C
- Refractive Index: 1.439
- PSA: 34.14
Tridecanal, 2-oxo- Related Literature
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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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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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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