Cas no 346664-00-4 (4-Chloro-N,N-diethyl-3-nitrobenzamide)
346664-00-4 structure
Product Name:4-Chloro-N,N-diethyl-3-nitrobenzamide
CAS No:346664-00-4
MF:C11H13ClN2O3
MW:256.685521841049
CID:3041818
PubChem ID:751292
Update Time:2024-11-05
4-Chloro-N,N-diethyl-3-nitrobenzamide Chemical and Physical Properties
Names and Identifiers
-
- 4-Chloro-N,N-diethyl-3-nitrobenzamide
- 4-Chloro-N,N-diethyl-3-nitrobenzamide,97%
- 346664-00-4
- SR-01000202300
- SR-01000202300-1
- Oprea1_714568
- AKOS000151470
-
- Inchi： 1S/C11H13ClN2O3/c1-3-13(4-2)11(15)8-5-6-9(12)10(7-8)14(16)17/h5-7H,3-4H2,1-2H3
- InChI Key： HWWLUMZDGRNXLU-UHFFFAOYSA-N
- SMILES： C(N(CC)CC)(=O)C1=CC=C(Cl)C([N+]([O-])=O)=C1
Computed Properties
- Exact Mass: 256.0614700g/mol
- Monoisotopic Mass: 256.0614700g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 289
- 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: 2.5
- Topological Polar Surface Area: 66.1?2
4-Chloro-N,N-diethyl-3-nitrobenzamide Related Literature
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
346664-00-4 (4-Chloro-N,N-diethyl-3-nitrobenzamide) Related Products
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