Cas no 833484-03-0 (Hexadecanoic acid, 16-hydroxy-9-[(1-oxopropyl)amino]-)
833484-03-0 structure
Product Name:Hexadecanoic acid, 16-hydroxy-9-[(1-oxopropyl)amino]-
CAS No:833484-03-0
MF:C19H37NO4
MW:343.501386404037
CID:672284
PubChem ID:11393773
Update Time:2025-04-19
Hexadecanoic acid, 16-hydroxy-9-[(1-oxopropyl)amino]- Chemical and Physical Properties
Names and Identifiers
-
- Hexadecanoic acid, 16-hydroxy-9-[(1-oxopropyl)amino]-
- 16-hydroxy-9-(propanoylamino)hexadecanoic acid
- DTXSID30464575
- 833484-03-0
-
- Inchi: 1S/C19H37NO4/c1-2-18(22)20-17(14-10-6-4-8-12-16-21)13-9-5-3-7-11-15-19(23)24/h17,21H,2-16H2,1H3,(H,20,22)(H,23,24)
- InChI Key: DNNFTGCMBFLNJU-UHFFFAOYSA-N
- SMILES: O=C(CC)NC(CCCCCCCO)CCCCCCCC(=O)O
Computed Properties
- Exact Mass: 343.27225866g/mol
- Monoisotopic Mass: 343.27225866g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 24
- Rotatable Bond Count: 17
- Complexity: 321
- 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: 86.6?2
Hexadecanoic acid, 16-hydroxy-9-[(1-oxopropyl)amino]- Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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2. Estimation of hydrogen sulfide from crude petroleum: a unique invention using a simple chemosensor?Shampa Kundu,Prithidipa Sahoo New J. Chem., 2019,43, 12369-12374
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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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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