Cas no 184844-07-3 (1,2-Dichloro-4-(diethoxymethyl)-5-nitrobenzene)
184844-07-3 structure
Product Name:1,2-Dichloro-4-(diethoxymethyl)-5-nitrobenzene
CAS No:184844-07-3
MF:C11H13Cl2NO4
MW:294.131221532822
CID:2784398
Update Time:2023-08-07
1,2-Dichloro-4-(diethoxymethyl)-5-nitrobenzene Chemical and Physical Properties
Names and Identifiers
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- 1,2-Dichloro-4-(diethoxymethyl)-5-nitrobenzene
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- Inchi： 1S/C11H13Cl2NO4/c1-3-17-11(18-4-2)7-5-8(12)9(13)6-10(7)14(15)16/h5-6,11H,3-4H2,1-2H3
- InChI Key： MOJARPVTTOBLMP-UHFFFAOYSA-N
- SMILES： ClC1C(=CC(=C(C=1)C(OCC)OCC)[N+](=O)[O-])Cl
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 5
- Complexity: 268
- XLogP3: 3.4
- Topological Polar Surface Area: 64.3
1,2-Dichloro-4-(diethoxymethyl)-5-nitrobenzene Related Literature
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Robert P. Davies,Maria A. Giménez,Laura Patel,Andrew J. P. White Dalton Trans., 2008, 5705-5707
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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