Cas no 28027-52-3 (1H-Indole-3-ethanamine,2-methyl-5-nitro-)
28027-52-3 structure
Product Name:1H-Indole-3-ethanamine,2-methyl-5-nitro-
CAS No:28027-52-3
MF:C11H13N3O2
MW:219.239822149277
CID:284833
PubChem ID:347108
Update Time:2025-04-19
1H-Indole-3-ethanamine,2-methyl-5-nitro- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indole-3-ethanamine,2-methyl-5-nitro-
- 2-(2-methyl-5-nitro-1H-indol-3-yl)ethanamine
- 2-(2-methyl-5-nitro-1H-indol-3-yl)-ethylamine
- 2-(2-Methyl-5-nitro-indol-3-yl)-aethylamin
- 2-(2-methyl-5-nitro-indol-3-yl)-ethylamine
- AC1L86IY
- BBL022125
- NSC405597
- Oprea1_113529
- ST044859
- STK134544
- SureCN6765948
- NSC-405597
- 2-(2-Methyl-5-nitro-1h-indol-3-yl)ethanamine, HCl
- 28027-52-3
- CHEMBL3609909
- DTXSID40324055
- SCHEMBL6765948
- AKOS001743009
- 2-(2-METHYL-5-NITRO-1H-INDOL-3-YL)ETHAN-1-AMINE
- CVTNZTGTHNNCTN-UHFFFAOYSA-N
-
- Inchi： 1S/C11H13N3O2/c1-7-9(4-5-12)10-6-8(14(15)16)2-3-11(10)13-7/h2-3,6,13H,4-5,12H2,1H3
- InChI Key： CVTNZTGTHNNCTN-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C=CC2=C(C=1)C(CCN)=C(C)N2)=O
Computed Properties
- Exact Mass: 219.10089
- Monoisotopic Mass: 219.101
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 266
- 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: 1.6
- Topological Polar Surface Area: 87.6?2
Experimental Properties
- Density: 1.316
- Boiling Point: 439.6°C at 760 mmHg
- Flash Point: 219.7°C
- Refractive Index: 1.68
- PSA: 84.95
- LogP: 3.10920
1H-Indole-3-ethanamine,2-methyl-5-nitro- Related Literature
-
Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
-
2. An investigation of the electrochemical delithiation process of carbon coated α-Fe2O3nanoparticlesAdrian Brandt,Florian Winter,Sebastian Klamor,Frank Berkemeier,Jatinkumar Rana,Rainer P?ttgen,Andrea Balducci J. Mater. Chem. A, 2013,1, 11229-11236
-
Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
-
Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
-
Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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