Cas no 100243-38-7 (Benzamide,2-(heptyloxy)-)
Benzamide,2-(heptyloxy)- structure
Product Name:Benzamide,2-(heptyloxy)-
CAS No:100243-38-7
MF:C14H21NO2
MW:235.32204413414
CID:153485
PubChem ID:57663
Update Time:2025-04-19
Benzamide,2-(heptyloxy)- Chemical and Physical Properties
Names and Identifiers
-
- Benzamide,2-(heptyloxy)-
- 2-heptoxybenzamide
- o-Heptyloxybenzamide
- Benzamide,o-(heptyloxy)- (6CI)
- BRN 3282264
- 100243-38-7
- H.P. 217
- DTXSID10143058
- BENZAMIDE, o-HEPTYLOXY-
- 2-n-Heptyloxybenzamide
-
- Inchi： 1S/C14H21NO2/c1-2-3-4-5-8-11-17-13-10-7-6-9-12(13)14(15)16/h6-7,9-10H,2-5,8,11H2,1H3,(H2,15,16)
- InChI Key： IQXXUMKLTPIHNP-UHFFFAOYSA-N
- SMILES： O(C1C=CC=CC=1C(N)=O)CCCCCCC
Computed Properties
- Exact Mass: 235.15733
- Monoisotopic Mass: 235.157229
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 8
- Complexity: 218
- 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: 3.7
- Topological Polar Surface Area: 52.3
Experimental Properties
- Density: 1.017
- Boiling Point: 370.8°Cat760mmHg
- Flash Point: 147.8°C
- Refractive Index: 1.514
- PSA: 52.32
- LogP: 3.83500
Benzamide,2-(heptyloxy)- 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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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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