Cas no 454422-74-3 ((3Ar,6aR)-1,4-Diethyl-3,6-dimethyltetrahydroimidazo[4,5-d]imidazole-2,5(1H,3H)-dione)
454422-74-3 structure
Product Name:(3Ar,6aR)-1,4-Diethyl-3,6-dimethyltetrahydroimidazo[4,5-d]imidazole-2,5(1H,3H)-dione
CAS No:454422-74-3
MF:C10H18N4O2
MW:226.275521755219
CID:929912
Update Time:2023-08-02
(3Ar,6aR)-1,4-Diethyl-3,6-dimethyltetrahydroimidazo[4,5-d]imidazole-2,5(1H,3H)-dione Chemical and Physical Properties
Names and Identifiers
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- Imidazo[4,5-d]imidazole-2,5(1H,3H)-dione, 1,4-diethyltetrahydro-3,6-dimethyl-, (3aR,6aR)- (9CI)
- (3aR,6aR)-1,4-Diethyl-3,6-dimethyltetrahydroimidazo[4,5-d]imidazole-2,5(1H,3H)-dione
- (3Ar,6aR)-1,4-Diethyl-3,6-dimethyltetrahydroimidazo[4,5-d]imidazole-2,5(1H,3H)-dione
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- Inchi: 1S/C10H18N4O2/c1-5-13-7-8(12(4)9(13)15)14(6-2)10(16)11(7)3/h7-8H,5-6H2,1-4H3/t7-,8-/m1/s1
- InChI Key: OYMJBLPBWFQYBE-HTQZYQBOSA-N
- SMILES: O=C1N(C)[C@H]2[C@H](N(C)C(N2CC)=O)N1CC
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 301
- Topological Polar Surface Area: 47.1
(3Ar,6aR)-1,4-Diethyl-3,6-dimethyltetrahydroimidazo[4,5-d]imidazole-2,5(1H,3H)-dione Related Literature
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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