Cas no 61360-89-2 (1,2,3,3-tetramethyl-6-nitro-2h-indole)
61360-89-2 structure
Product Name:1,2,3,3-tetramethyl-6-nitro-2h-indole
CAS No:61360-89-2
MF:C12H16N2O2
MW:220.267642974854
CID:954360
PubChem ID:333986
Update Time:2025-04-19
1,2,3,3-tetramethyl-6-nitro-2h-indole Chemical and Physical Properties
Names and Identifiers
-
- 1,2,3,3-tetramethyl-6-nitro-2h-indole
- 1,2,3,3-tetramethyl-6-nitroindoline
- 6-Nitro-1,2,3,3-tetramethylindoline
- AC1L7EFV
- NSC338154
- SureCN9066778
- SCHEMBL9066778
- NSC-338154
- 61360-89-2
- 1,2,3,3-Tetramethyl-6-nitro-2,3-dihydro-1H-indole
- DTXSID70318947
-
- Inchi： 1S/C12H16N2O2/c1-8-12(2,3)10-6-5-9(14(15)16)7-11(10)13(8)4/h5-8H,1-4H3
- InChI Key： BYHFGPIICGZZNB-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C=CC2=C(C=1)N(C)C(C)C2(C)C)=O
Computed Properties
- Exact Mass: 220.12128
- Monoisotopic Mass: 220.121177757g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 0
- Complexity: 298
- 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
- XLogP3: 3.2
- Topological Polar Surface Area: 49.1?2
Experimental Properties
- PSA: 46.38
- LogP: 3.29890
1,2,3,3-tetramethyl-6-nitro-2h-indole Related Literature
-
Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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