Cas no 7716-87-2 (5'-chloro-2'-nitrobiphenyl-2-carbaldehyde)
7716-87-2 structure
Product Name:5'-chloro-2'-nitrobiphenyl-2-carbaldehyde
CAS No:7716-87-2
MF:C13H8ClNO3
MW:261.660522460938
CID:1783674
PubChem ID:12315668
Update Time:2025-04-21
5'-chloro-2'-nitrobiphenyl-2-carbaldehyde Chemical and Physical Properties
Names and Identifiers
-
- 5'-chloro-2'-nitrobiphenyl-2-carbaldehyde
- (5-chloro-2-nitrophenyl)-phenylmethanone
- Benzophenone, 5-chloro-2-nitro-
- 7716-87-2
- Methanone, (5-chloro-2-nitrophenyl)phenyl-
- DTXSID60227918
- (5-Chloro-2-nitrophenyl)phenylmethanone
- SCHEMBL25413293
-
- Inchi： 1S/C13H8ClNO3/c14-10-6-7-12(15(17)18)11(8-10)13(16)9-4-2-1-3-5-9/h1-8H
- InChI Key： ZXNFXLWABOISKA-UHFFFAOYSA-N
- SMILES： ClC1C=CC(=C(C=1)C(C1C=CC=CC=1)=O)[N+](=O)[O-]
Computed Properties
- Exact Mass: 261.01934
- Monoisotopic Mass: 261.019271
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 318
- 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: 3.6
- Topological Polar Surface Area: 62.9
Experimental Properties
- Density: 1.375
- Boiling Point: 420.7°C at 760 mmHg
- Flash Point: 208.2°C
- Refractive Index: 1.646
- PSA: 60.21
5'-chloro-2'-nitrobiphenyl-2-carbaldehyde Related Literature
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
-
J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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