Cas no 59137-99-4 (2,4(1H,3H)-Pyrimidinedione,5-(1-cyclohexen-1-ylmethyl)-)
59137-99-4 structure
Product Name:2,4(1H,3H)-Pyrimidinedione,5-(1-cyclohexen-1-ylmethyl)-
CAS No:59137-99-4
MF:C11H14N2O2
MW:206.241062641144
CID:380807
PubChem ID:337420
Update Time:2025-04-19
2,4(1H,3H)-Pyrimidinedione,5-(1-cyclohexen-1-ylmethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2,4(1H,3H)-Pyrimidinedione,5-(1-cyclohexen-1-ylmethyl)-
- 5-(cyclohexen-1-ylmethyl)-1H-pyrimidine-2,4-dione
- 5-(1-cyclohexen-1-ylmethyl)-2,4(1H,3H)-pyrimidinedione
- 5-cyclohex-1-enylmethyl-1H-pyrimidine-2,4-dione
- AC1L7LOH
- NSC355347
- 59137-99-4
- NSC-355347
- DTXSID30320127
-
- Inchi： 1S/C11H14N2O2/c14-10-9(7-12-11(15)13-10)6-8-4-2-1-3-5-8/h4,7H,1-3,5-6H2,(H2,12,13,14,15)
- InChI Key： AFFUOWNMWUFBDC-UHFFFAOYSA-N
- SMILES： O=C1C(=CNC(N1)=O)CC1=CCCCC1
Computed Properties
- Exact Mass: 206.10562
- Monoisotopic Mass: 206.105527694g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 356
- 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: 1
- Topological Polar Surface Area: 58.2?2
Experimental Properties
- PSA: 58.2
- LogP: 1.10610
2,4(1H,3H)-Pyrimidinedione,5-(1-cyclohexen-1-ylmethyl)- Related Literature
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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