Cas no 96817-38-8 (2,3a'-dimethyltetrahydrospiro[furan-3,2'-furo[2,3-d][1,3]dioxole]-2,6a'(3a'H)-diol (non-preferred name))
96817-38-8 structure
Product Name:2,3a'-dimethyltetrahydrospiro[furan-3,2'-furo[2,3-d][1,3]dioxole]-2,6a'(3a'H)-diol (non-preferred name)
CAS No:96817-38-8
MF:C10H16O6
MW:232.230443954468
CID:1987925
PubChem ID:178911
Update Time:2025-04-21
2,3a'-dimethyltetrahydrospiro[furan-3,2'-furo[2,3-d][1,3]dioxole]-2,6a'(3a'H)-diol (non-preferred name) Chemical and Physical Properties
Names and Identifiers
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- 2,3a'-dimethyltetrahydrospiro[furan-3,2'-furo[2,3-d][1,3]dioxole]-2,6a'(3a'H)-diol (non-preferred name)
- 2',3a-dimethylspiro[5,6-dihydrofuro[2,3-d][1,3]dioxole-2,3'-oxolane]-2',6a-diol
- 96817-38-8
- Spiro(furan-3(2H),2'-furo(2,3-d)(1,3)dioxole)-2,6'a(3'aH)-diol, tetrahydro-2,3'a-dimethyl-, (2'alpha(R*),3'aalpha,6'aalpha)-(-)-
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- Inchi: 1S/C10H16O6/c1-7(11)10(4-6-13-7)15-8(2)9(12,16-10)3-5-14-8/h11-12H,3-6H2,1-2H3
- InChI Key: YHLRNPBYCYKONM-UHFFFAOYSA-N
- SMILES: CC1(C2(OC3(C(OCC3)(C)O2)O)CCO1)O
Computed Properties
- Exact Mass: 232.095
- Monoisotopic Mass: 232.095
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 16
- Rotatable Bond Count: 0
- Complexity: 335
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 4
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -1
- Topological Polar Surface Area: 77.4?2
Experimental Properties
- Density: 1.45
- Boiling Point: 392.4°C at 760 mmHg
- Flash Point: 191.1°C
- Refractive Index: 1.569
2,3a'-dimethyltetrahydrospiro[furan-3,2'-furo[2,3-d][1,3]dioxole]-2,6a'(3a'H)-diol (non-preferred name) Related Literature
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
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Mei-Yu Xu,Ya-Ting Wang,Qing-Ling Ni,Zi-Hao Zhang,Guang-Ming Liang,Liu-Cheng Gui Dalton Trans., 2016,45, 4993-4997
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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