Cas no 156733-00-5 (1-Cyclopropene-1-pentanoicacid, 2-octadecyl-, methyl ester)
156733-00-5 structure
Product Name:1-Cyclopropene-1-pentanoicacid, 2-octadecyl-, methyl ester
CAS No:156733-00-5
MF:C27H50O2
MW:406.684709072113
CID:160148
PubChem ID:190849
Update Time:2025-04-19
1-Cyclopropene-1-pentanoicacid, 2-octadecyl-, methyl ester Chemical and Physical Properties
Names and Identifiers
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- 1-Cyclopropene-1-pentanoicacid, 2-octadecyl-, methyl ester
- Methyl 3-(2-octadecylcyclopropen-1-yl)pentanoate
- methyl 5-(2-octadecylcycloprop-1-en-1-yl)pentanoate
- Methyl odc-pentanoate
- methyl 3-(2-octadecylcyclopropen--1-yl)pentanoate
- DTXSID20935522
- 156733-00-5
- methyl 5-(2-octadecylcyclopropen-1-yl)pentanoate
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- Inchi： 1S/C27H50O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-25-24-26(25)22-19-20-23-27(28)29-2/h3-24H2,1-2H3
- InChI Key： SSVRHBGDDJATMX-UHFFFAOYSA-N
- SMILES： O(C)C(CCCCC1CC=1CCCCCCCCCCCCCCCCCC)=O
Computed Properties
- Exact Mass: 406.3813
- Monoisotopic Mass: 406.381
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 29
- Rotatable Bond Count: 23
- Complexity: 424
- 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: 10.6
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- Density: 0.901
- Boiling Point: 481.1°Cat760mmHg
- Flash Point: 86.8°C
- Refractive Index: 1.472
- PSA: 26.3
1-Cyclopropene-1-pentanoicacid, 2-octadecyl-, methyl ester Related Literature
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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2. 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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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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