Cas no 93820-43-0 (isooctanoic acid, compound with cyclohexylamine (1:1))
93820-43-0 structure
Product Name:isooctanoic acid, compound with cyclohexylamine (1:1)
CAS No:93820-43-0
MF:C14H29NO2
MW:243.385564565659
CID:1983319
PubChem ID:44153406
Update Time:2025-04-21
isooctanoic acid, compound with cyclohexylamine (1:1) Chemical and Physical Properties
Names and Identifiers
-
- isooctanoic acid, compound with cyclohexylamine (1:1)
- cyclohexanamine,6-methylheptanoic acid
- 6-Methylheptanoic acid--cyclohexanamine (1/1)
- DTXSID50917735
- EINECS 298-622-2
- 93820-43-0
-
- Inchi： 1S/C8H16O2.C6H13N/c1-7(2)5-3-4-6-8(9)10;7-6-4-2-1-3-5-6/h7H,3-6H2,1-2H3,(H,9,10);6H,1-5,7H2
- InChI Key： JPXIRBIAASOZOR-UHFFFAOYSA-N
- SMILES： OC(CCCCC(C)C)=O.NC1CCCCC1
Computed Properties
- Exact Mass: 243.22
- Monoisotopic Mass: 243.22
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 5
- Complexity: 144
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 63.3A^2
isooctanoic acid, compound with cyclohexylamine (1:1) Related Literature
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1. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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4. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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