Cas no 1092-56-4 (Benzene,1,1'-methylenebis[4-iodo-2-nitro-)
1092-56-4 structure
Product Name:Benzene,1,1'-methylenebis[4-iodo-2-nitro-
CAS No:1092-56-4
MF:C13H8I2N2O4
MW:510.022567749023
CID:207507
PubChem ID:254541
Update Time:2025-04-19
Benzene,1,1'-methylenebis[4-iodo-2-nitro- Chemical and Physical Properties
Names and Identifiers
-
- 4-iodo-1-[(4-iodo-2-nitrophenyl)methyl]-2-nitrobenzene
- Methane,bis(4-iodo-2-nitrophenyl)- (7CI,8CI)
- NSC 78955
- 1,1'-methanediylbis(4-iodo-2-nitrobenzene)
- 1092-56-4
- NSC-78955
- NSC78955
- DTXSID20291892
- Benzene,1,1'-methylenebis[4-iodo-2-nitro-
-
- Inchi： 1S/C13H8I2N2O4/c14-10-3-1-8(12(6-10)16(18)19)5-9-2-4-11(15)7-13(9)17(20)21/h1-4,6-7H,5H2
- InChI Key： SCJKFZVYCPRQEH-UHFFFAOYSA-N
- SMILES： IC1C=CC(=C(C=1)[N+](=O)[O-])CC1C=CC(=CC=1[N+](=O)[O-])I
Computed Properties
- Exact Mass: 509.85644
- Monoisotopic Mass: 509.857
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 21
- Rotatable Bond Count: 2
- Complexity: 363
- 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: 4.8
- Topological Polar Surface Area: 91.6?2
Experimental Properties
- Density: 2.155
- Boiling Point: 485.5°Cat760mmHg
- Flash Point: 247.4°C
- Refractive Index: 1.73
- PSA: 86.28
- LogP: 5.34940
Benzene,1,1'-methylenebis[4-iodo-2-nitro- Related Literature
-
Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
-
A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
-
Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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