Cas no 58353-63-2 (Benzene, dodecylnitro-)
Benzene, dodecylnitro- structure
Product Name:Benzene, dodecylnitro-
CAS No:58353-63-2
MF:C18H29NO2
MW:291.428365468979
CID:375630
PubChem ID:162853
Update Time:2025-04-19
Benzene, dodecylnitro- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, dodecylnitro-
- 1-dodecyl-2-nitrobenzene
- DODECYLNITROBENZENE
- 58353-63-2
- DTXSID6069246
- NS00033909
- EINECS 261-221-8
-
- Inchi： 1S/C18H29NO2/c1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16-18(17)19(20)21/h12-13,15-16H,2-11,14H2,1H3
- InChI Key： QWLHSHGYLNXYPS-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C=CC=CC=1CCCCCCCCCCCC)=O
Computed Properties
- Exact Mass: 291.21997
- Monoisotopic Mass: 291.22
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 21
- Rotatable Bond Count: 11
- Complexity: 262
- 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
- Topological Polar Surface Area: 45.8A^2
- XLogP3: 8
Experimental Properties
- Density: 0.974
- Boiling Point: 385.8°Cat760mmHg
- Flash Point: 151.2°C
- Refractive Index: 1.504
- PSA: 43.14
Benzene, dodecylnitro- Related Literature
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Jing Chen,Yu Shao,Danzhen Li J. Mater. Chem. A, 2017,5, 937-941
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2. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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