Cas no 6145-89-7 (5-morpholin-4-yl-N-(3-morpholin-4-ylpropyl)-2-nitroaniline)
6145-89-7 structure
Product Name:5-morpholin-4-yl-N-(3-morpholin-4-ylpropyl)-2-nitroaniline
CAS No:6145-89-7
MF:C17H26N4O4
MW:350.412744045258
CID:1628286
PubChem ID:2888090
Update Time:2025-04-21
5-morpholin-4-yl-N-(3-morpholin-4-ylpropyl)-2-nitroaniline Chemical and Physical Properties
Names and Identifiers
-
- 5-morpholin-4-yl-N-(3-morpholin-4-ylpropyl)-2-nitroaniline
- 4-Morpholinepropanamine, N-[5-(4-morpholinyl)-2-nitrophenyl]-
- 5-(Morpholin-4-yl)-N-[3-(morpholin-4-yl)propyl]-2-nitroaniline
- EU-0019043
- SR-01000530362
- BIM-0047150.P001
- STK082293
- CBMicro_047170
- (5-morpholin-4-yl-2-nitrophenyl)(3-morpholin-4-ylpropyl)amine
- SR-01000530362-1
- AKOS000423849
- 5-(4-morpholinyl)-N-[3-(4-morpholinyl)propyl]-2-nitroaniline
- 6145-89-7
- DTXSID90387377
-
- Inchi： 1S/C17H26N4O4/c22-21(23)17-3-2-15(20-8-12-25-13-9-20)14-16(17)18-4-1-5-19-6-10-24-11-7-19/h2-3,14,18H,1,4-13H2
- InChI Key： BHBGCWPAOYWEBC-UHFFFAOYSA-N
- SMILES： O1CCN(CC1)CCCNC1=C(C=CC(=C1)N1CCOCC1)[N+](=O)[O-]
Computed Properties
- Exact Mass: 350.19558
- Monoisotopic Mass: 350.19540532g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 25
- Rotatable Bond Count: 6
- Complexity: 408
- 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: 2.1
- Topological Polar Surface Area: 82.8?2
Experimental Properties
- PSA: 80.11
5-morpholin-4-yl-N-(3-morpholin-4-ylpropyl)-2-nitroaniline Related Literature
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
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