Cas no 88515-93-9 (Benzene, 2-chloro-5-[(4-chloro-3-nitrophenyl)methyl]-1-methyl-3-nitro-)
![Benzene, 2-chloro-5-[(4-chloro-3-nitrophenyl)methyl]-1-methyl-3-nitro- structure](https://ossimg.kuujia.com/scimg/89000/88515-93-9x500.png)
88515-93-9 structure
Product Name:Benzene, 2-chloro-5-[(4-chloro-3-nitrophenyl)methyl]-1-methyl-3-nitro-
CAS No:88515-93-9
MF:C14H10Cl2N2O4
MW:341.146201610565
CID:630146
PubChem ID:71318460
Update Time:2025-04-19
Benzene, 2-chloro-5-[(4-chloro-3-nitrophenyl)methyl]-1-methyl-3-nitro- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 2-chloro-5-[(4-chloro-3-nitrophenyl)methyl]-1-methyl-3-nitro-
- 2-chloro-5-[(4-chloro-3-nitrophenyl)methyl]-1-methyl-3-nitrobenzene
- DTXSID40748570
- 88515-93-9
-
- Inchi： 1S/C14H10Cl2N2O4/c1-8-4-10(7-13(14(8)16)18(21)22)5-9-2-3-11(15)12(6-9)17(19)20/h2-4,6-7H,5H2,1H3
- InChI Key： YYENMYIQHQNBLT-UHFFFAOYSA-N
- SMILES： ClC1C(=CC(=CC=1C)CC1C=CC(=C(C=1)[N+](=O)[O-])Cl)[N+](=O)[O-]
Computed Properties
- Exact Mass: 340.0017622g/mol
- Monoisotopic Mass: 340.0017622g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 22
- Rotatable Bond Count: 2
- Complexity: 426
- 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: 5.1
- Topological Polar Surface Area: 91.6?2
Benzene, 2-chloro-5-[(4-chloro-3-nitrophenyl)methyl]-1-methyl-3-nitro- Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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