Cas no 102767-27-1 (1,2-Propanediol,3-[[4-[(2-hydroxyethyl)methylamino]-2-nitrophenyl]amino]-)
![1,2-Propanediol,3-[[4-[(2-hydroxyethyl)methylamino]-2-nitrophenyl]amino]- structure](https://ossimg.kuujia.com/scimg/103000/102767-27-1x500.png)
102767-27-1 structure
Product Name:1,2-Propanediol,3-[[4-[(2-hydroxyethyl)methylamino]-2-nitrophenyl]amino]-
CAS No:102767-27-1
MF:C12H19N3O5
MW:285.296363115311
CID:125229
PubChem ID:21832405
Update Time:2025-04-18
1,2-Propanediol,3-[[4-[(2-hydroxyethyl)methylamino]-2-nitrophenyl]amino]- Chemical and Physical Properties
Names and Identifiers
-
- 1,2-Propanediol,3-[[4-[(2-hydroxyethyl)methylamino]-2-nitrophenyl]amino]-
- HCBLUE10
- HC BLUE NO. 10
- HC Blue 10
- DTXSID00879793
- 102767-27-1
- SCHEMBL111249
- 3-[4-[2-hydroxyethyl(methyl)amino]-2-nitroanilino]propane-1,2-diol
- 3-((4-((2-Hydroxyethyl)(methyl)amino)-2-nitrophenyl)amino)propane-1,2-diol
-
- Inchi： 1S/C12H19N3O5/c1-14(4-5-16)9-2-3-11(12(6-9)15(19)20)13-7-10(18)8-17/h2-3,6,10,13,16-18H,4-5,7-8H2,1H3
- InChI Key： ICMWDHODFTWYFK-UHFFFAOYSA-N
- SMILES： OC(CO)CNC1C=CC(=CC=1[N+](=O)[O-])N(C)CCO
Computed Properties
- Exact Mass: 16.03132
- Monoisotopic Mass: 285.132
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 20
- Rotatable Bond Count: 7
- Complexity: 299
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 122A^2
- XLogP3: 0.4
Experimental Properties
- PSA: 0
1,2-Propanediol,3-[[4-[(2-hydroxyethyl)methylamino]-2-nitrophenyl]amino]- Related Literature
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Alena Koukalová,?árka Pokorná,Aimee L. Boyle,Nestor Lopez Mora,Alexander Kros,Martin Hof,Radek ?achl Nanoscale, 2018,10, 19064-19073
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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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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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
102767-27-1 (1,2-Propanediol,3-[[4-[(2-hydroxyethyl)methylamino]-2-nitrophenyl]amino]-) Related Products
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