Cas no 110346-63-9 (Heptanoic acid, 7-nitro-)
Heptanoic acid, 7-nitro- structure
Product Name:Heptanoic acid, 7-nitro-
CAS No:110346-63-9
MF:C7H13NO4
MW:175.182422399521
CID:1197880
Update Time:2024-08-05
Heptanoic acid, 7-nitro- Chemical and Physical Properties
Names and Identifiers
-
- Heptanoic acid, 7-nitro-
- 7-nitroheptanoic acid
-
- Inchi： 1S/C7H13NO4/c9-7(10)5-3-1-2-4-6-8(11)12/h1-6H2,(H,9,10)
- InChI Key： QWAOHUZGVCJBLA-UHFFFAOYSA-N
- SMILES： C(O)(=O)CCCCCC[N+]([O-])=O
Computed Properties
- Exact Mass: 175.08449
Experimental Properties
- Density: 1.156±0.06 g/cm3(Predicted)
- Melting Point: 41-42 °C
- Boiling Point: 325.7±25.0 °C(Predicted)
- PSA: 80.44
- pka: 4.75±0.10(Predicted)
Heptanoic acid, 7-nitro- Related Literature
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S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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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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Patricia A. A. M. Vaz,Jo?o Rocha,Artur M. S. Silva New J. Chem., 2016,40, 8198-8201
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