Cas no 5299-73-0 (Morpholine, 4-(1-oxo-2,4-hexadienyl)-)
5299-73-0 structure
Product Name:Morpholine, 4-(1-oxo-2,4-hexadienyl)-
CAS No:5299-73-0
MF:C10H15NO2
MW:181.231602907181
CID:358288
PubChem ID:71365417
Update Time:2025-04-19
Morpholine, 4-(1-oxo-2,4-hexadienyl)- Chemical and Physical Properties
Names and Identifiers
-
- Morpholine, 4-(1-oxo-2,4-hexadienyl)-
- 1-morpholin-4-ylhexa-2,4-dien-1-one
- 1-(Morpholin-4-yl)hexa-2,4-dien-1-one
- 5299-73-0
- DTXSID40788835
-
- Inchi： 1S/C10H15NO2/c1-2-3-4-5-10(12)11-6-8-13-9-7-11/h2-5H,6-9H2,1H3
- InChI Key： YHFCLKOVFYITAG-UHFFFAOYSA-N
- SMILES： O1CCN(C(C=CC=CC)=O)CC1
Computed Properties
- Exact Mass: 181.11035
- Monoisotopic Mass: 181.110278721g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 215
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 2
- XLogP3: 0.8
- Topological Polar Surface Area: 29.5?2
Experimental Properties
- PSA: 29.54
Morpholine, 4-(1-oxo-2,4-hexadienyl)- Related Literature
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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