Cas no 93966-45-1 (Hexanedioic acid,1-[(tetrahydro-2-furanyl)methyl] ester)
![Hexanedioic acid,1-[(tetrahydro-2-furanyl)methyl] ester structure](https://ossimg.kuujia.com/scimg/94000/93966-45-1x500.png)
93966-45-1 structure
Product Name:Hexanedioic acid,1-[(tetrahydro-2-furanyl)methyl] ester
CAS No:93966-45-1
MF:C11H18O5
MW:230.257624149323
CID:805095
PubChem ID:22184280
Update Time:2025-04-19
Hexanedioic acid,1-[(tetrahydro-2-furanyl)methyl] ester Chemical and Physical Properties
Names and Identifiers
-
- Hexanedioic acid,1-[(tetrahydro-2-furanyl)methyl] ester
- 6-oxo-6-(oxolan-2-ylmethoxy)hexanoic acid
- tetrahydrofurfuryl hydrogen adipate
- NS00064400
- 6-Oxo-6-[(oxolan-2-yl)methoxy]hexanoic acid
- DTXSID50916809
- 93966-45-1
- SCHEMBL5665873
- EINECS 300-997-5
-
- Inchi： 1S/C11H18O5/c12-10(13)5-1-2-6-11(14)16-8-9-4-3-7-15-9/h9H,1-8H2,(H,12,13)
- InChI Key： MYAALGBQWWRACC-UHFFFAOYSA-N
- SMILES： O1CCCC1COC(CCCCC(=O)O)=O
Computed Properties
- Exact Mass: 230.11542367g/mol
- Monoisotopic Mass: 230.11542367g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 16
- Rotatable Bond Count: 8
- Complexity: 239
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.7
- Topological Polar Surface Area: 72.8?2
Experimental Properties
- Density: 1.163
- Boiling Point: 388.6°Cat760mmHg
- Flash Point: 148.4°C
- Refractive Index: 1.476
Hexanedioic acid,1-[(tetrahydro-2-furanyl)methyl] ester 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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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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