Cas no 115084-49-6 (Benzenamine,2-chloro-4-[(3-chloro-4-nitrophenyl)methyl]-)
![Benzenamine,2-chloro-4-[(3-chloro-4-nitrophenyl)methyl]- structure](https://ossimg.kuujia.com/scimg/115500/115084-49-6x500.png)
115084-49-6 structure
Product Name:Benzenamine,2-chloro-4-[(3-chloro-4-nitrophenyl)methyl]-
CAS No:115084-49-6
MF:C13H10Cl2N2O2
MW:297.136701107025
CID:215528
PubChem ID:189271
Update Time:2025-04-19
Benzenamine,2-chloro-4-[(3-chloro-4-nitrophenyl)methyl]- Chemical and Physical Properties
Names and Identifiers
-
- Benzenamine,2-chloro-4-[(3-chloro-4-nitrophenyl)methyl]-
- 2-chloro-4-[(3-chloro-4-nitrophenyl)methyl]aniline
- 115084-49-6
- 2-Chloro-4-((3-chloro-4-nitrophenyl)methyl)aniline
- DTXSID00150953
-
- Inchi： 1S/C13H10Cl2N2O2/c14-10-6-8(1-3-12(10)16)5-9-2-4-13(17(18)19)11(15)7-9/h1-4,6-7H,5,16H2
- InChI Key： LWKNJSDFOFWBEF-UHFFFAOYSA-N
- SMILES： ClC1=C(C=CC(=C1)CC1C=CC(=C(C=1)Cl)N)[N+](=O)[O-]
Computed Properties
- Exact Mass: 296.0121
- Monoisotopic Mass: 296.0119330g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 324
- 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: 4.2
- Topological Polar Surface Area: 71.8?2
Experimental Properties
- PSA: 69.16
Benzenamine,2-chloro-4-[(3-chloro-4-nitrophenyl)methyl]- Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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