Cas no 272438-27-4 (4(1H)-Phenanthrenone,2,3-dihydro-9-nitro-)
272438-27-4 structure
Product Name:4(1H)-Phenanthrenone,2,3-dihydro-9-nitro-
CAS No:272438-27-4
MF:C14H11NO3
MW:241.242043733597
CID:254683
PubChem ID:3025977
Update Time:2025-04-19
4(1H)-Phenanthrenone,2,3-dihydro-9-nitro- Chemical and Physical Properties
Names and Identifiers
-
- 4(1H)-Phenanthrenone,2,3-dihydro-9-nitro-
- 9-nitro-2,3-dihydro-1H-phenanthren-4-one
- CCRIS 8477
- QN2FT7DCL4
- DTXSID70181698
- 4-Keto-9-nitrotetrahydrophenanthrene
- 4-KETO-9-NITRO-TETRAHYDROPHENANTHRENE
- 9-Nitro-2,3-dihydro-4(1H)-phenanthrenone
- 4(1H)-Phenanthrenone, 2,3-dihydro-9-nitro-
- 2,3-Dihydro-9-nitro-4(1H)-phenanthrenone
- 272438-27-4
-
- Inchi： 1S/C14H11NO3/c16-13-7-3-4-9-8-12(15(17)18)10-5-1-2-6-11(10)14(9)13/h1-2,5-6,8H,3-4,7H2
- InChI Key： RCOFNSRTQHKSFT-UHFFFAOYSA-N
- SMILES： O=C1CCCC2C=C(C3C=CC=CC=3C=21)[N+](=O)[O-]
Computed Properties
- Exact Mass: 241.07393
- Monoisotopic Mass: 241.074
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 0
- Complexity: 363
- 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: 3.1
- Topological Polar Surface Area: 62.9?2
Experimental Properties
- Density: 1.349
- Boiling Point: 449.8°C at 760 mmHg
- Flash Point: 227.6°C
- Refractive Index: 1.68
- PSA: 60.21
4(1H)-Phenanthrenone,2,3-dihydro-9-nitro- Related Literature
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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