Cas no 69779-93-7 (Copper,dichlorobis(1,3-dimethyl-2,4(1H,3H)-pyrimidinedione-O4)-, (SP-4-1)- (9CI))
69779-93-7 structure
Product Name:Copper,dichlorobis(1,3-dimethyl-2,4(1H,3H)-pyrimidinedione-O4)-, (SP-4-1)- (9CI)
CAS No:69779-93-7
MF:C12H16Cl2CuN4O4
MW:414.731842041016
CID:515385
PubChem ID:191916
Update Time:2025-04-19
Copper,dichlorobis(1,3-dimethyl-2,4(1H,3H)-pyrimidinedione-O4)-, (SP-4-1)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Copper,dichlorobis(1,3-dimethyl-2,4(1H,3H)-pyrimidinedione-O4)-, (SP-4-1)- (9CI)
- Copper, dichlorobis(1,3-dimethyl-2,4(1H,3H)-pyrimidinedione-O4)-, (SP-4-1)-
- Copper(2+) chloride--1,3-dimethylpyrimidine-2,4(1H,3H)-dione (1/2/2)
- DTXSID30989955
- copper;1,3-dimethylpyrimidine-2,4-dione;dichloride
- Bis-(1,3-dimethyluracil)dichlorocopper(II)
- 69779-93-7
-
- Inchi： 1S/2C6H8N2O2.2ClH.Cu/c2*1-7-4-3-5(9)8(2)6(7)10;;;/h2*3-4H,1-2H3;2*1H;/q;;;;+2/p-2
- InChI Key： FXTFGAHVMFMGLB-UHFFFAOYSA-L
- SMILES： [Cu+2].[Cl-].[Cl-].O=C1N(C)C=CC(N1C)=O.O=C1N(C)C=CC(N1C)=O
Computed Properties
- Exact Mass: 412.984
- Monoisotopic Mass: 412.984
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 23
- Rotatable Bond Count: 0
- Complexity: 210
- Covalently-Bonded Unit Count: 5
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 81.2?2
Experimental Properties
- Boiling Point: 208.4°Cat760mmHg
- Flash Point: 84.3°C
Copper,dichlorobis(1,3-dimethyl-2,4(1H,3H)-pyrimidinedione-O4)-, (SP-4-1)- (9CI) Related Literature
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Raheleh Torabi,Hedayatollah Ghourchian,Massoud Amanlou Org. Biomol. Chem., 2016,14, 8141-8153
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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