Cas no 648908-48-9 (Tridecanoic acid, 3-(acetylamino)-)
648908-48-9 structure
Product Name:Tridecanoic acid, 3-(acetylamino)-
CAS No:648908-48-9
MF:C15H29NO3
MW:271.395664930344
CID:412708
PubChem ID:71378066
Update Time:2025-04-19
Tridecanoic acid, 3-(acetylamino)- Chemical and Physical Properties
Names and Identifiers
-
- Tridecanoic acid, 3-(acetylamino)-
- 3-acetamidotridecanoic acid
- 3-Acetamidotridecanoato
- 648908-48-9
- DTXSID00800688
-
- Inchi： 1S/C15H29NO3/c1-3-4-5-6-7-8-9-10-11-14(12-15(18)19)16-13(2)17/h14H,3-12H2,1-2H3,(H,16,17)(H,18,19)
- InChI Key： OKEKYRGPFSUBAK-UHFFFAOYSA-N
- SMILES： OC(CC(CCCCCCCCCC)NC(C)=O)=O
Computed Properties
- Exact Mass: 271.21487
- Monoisotopic Mass: 271.21474379g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 19
- Rotatable Bond Count: 12
- Complexity: 254
- 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: 4.1
- Topological Polar Surface Area: 66.4?2
Experimental Properties
- PSA: 66.4
Tridecanoic acid, 3-(acetylamino)- Related Literature
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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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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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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