Cas no 84254-93-3 (Benzenamine,2,4-dichloro-6-methoxy-, hydrochloride (1:1))
84254-93-3 structure
Product Name:Benzenamine,2,4-dichloro-6-methoxy-, hydrochloride (1:1)
CAS No:84254-93-3
MF:C7H8Cl3NO
MW:228.503519058228
CID:723675
PubChem ID:5743826
Update Time:2025-04-19
Benzenamine,2,4-dichloro-6-methoxy-, hydrochloride (1:1) Chemical and Physical Properties
Names and Identifiers
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- Benzenamine,2,4-dichloro-6-methoxy-, hydrochloride (1:1)
- (2,4-dichloro-6-methoxyphenyl)azanium,chloride
- 2,4-dichloro-6-methoxyanilinium chloride
- 84254-93-3
- NS00089475
- EINECS 282-539-3
-
- Inchi： 1S/C7H7Cl2NO.ClH/c1-11-6-3-4(8)2-5(9)7(6)10;/h2-3H,10H2,1H3;1H
- InChI Key： UPNRYPFDYAGGHH-UHFFFAOYSA-N
- SMILES： ClC1=CC(=CC(=C1[NH3+])OC)Cl.[Cl-]
Computed Properties
- Exact Mass: 226.967147
- Monoisotopic Mass: 226.967147
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 134
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 36.9
Experimental Properties
- Boiling Point: 273.9°C at 760 mmHg
- Flash Point: 119.4°C
Benzenamine,2,4-dichloro-6-methoxy-, hydrochloride (1:1) Related Literature
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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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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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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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